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1231889-53-4,MFCD30470964
Catalog No.:AA01EO5Q

1231889-53-4 | BMS-935177

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
95%
1 week  
$127.00   $89.00
- +
2mg
95%
1 week  
$159.00   $112.00
- +
5mg
95%
1 week  
$261.00   $183.00
- +
25mg
99%
1 week  
$1,193.00   $835.00
- +
50mg
99%
1 week  
$2,035.00   $1,424.00
- +
100mg
99%
1 week  
$3,384.00   $2,369.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA01EO5Q
Chemical Name:
BMS-935177
CAS Number:
1231889-53-4
Molecular Formula:
C31H26N4O3
Molecular Weight:
502.5631
MDL Number:
MFCD30470964
SMILES:
Cc1c(cccc1n1cnc2c(c1=O)cccc2)c1ccc(c2c1c1ccc(cc1[nH]2)C(O)(C)C)C(=O)N
Properties
Computed Properties
 
Complexity:
951  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
38  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4.5  

Literature

Title: Discovery of 6-Fluoro-5-(R)-(3-(S)-(8-fluoro-1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-2-methylphenyl)-2-(S)-(2-hydroxypropan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole-8-carboxamide (BMS-986142): A Reversible Inhibitor of Bruton's Tyrosine Kinase (BTK) Conformationally Constrained by Two Locked Atropisomers.

Journal: Journal of medicinal chemistry 20161013

Title: The effect of acid treatment upon the susceptibility of rabbit IgG to proteolytic cleavage with various enzymes.

Journal: Immunochemistry 19750801

Title: De Lucca GV, et al. Small Molecule Reversible Inhibitors of Bruton's Tyrosine Kinase (BTK): Structure-Activity Relationships Leading to the Identification of 7-(2-Hydroxypropan-2-yl)-4--methyl-3-(4-oxo-3,4-dihydroquinazolin-3-yl)phenyl-9H-carbazole-1-carboxamide (BMS-935177). J Med Chem. 2016 Sep 8;59(17):7915-35.

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Tags:1231889-53-4 Molecular Formula|1231889-53-4 MDL|1231889-53-4 SMILES|1231889-53-4 BMS-935177
Catalog No.: AA01EO5Q
1231889-53-4,MFCD30470964
1231889-53-4 | BMS-935177
Pack Size： 1mg
Purity： 95%
1 week
$127.00 $89.00
Pack Size： 2mg
Purity： 95%
1 week
$159.00 $112.00
Pack Size： 5mg
Purity： 95%
1 week
$261.00 $183.00
Pack Size： 25mg
Purity： 99%
1 week
$1,193.00 $835.00
Pack Size： 50mg
Purity： 99%
1 week
$2,035.00 $1,424.00
Pack Size： 100mg
Purity： 99%
1 week
$3,384.00 $2,369.00
Quantity
- +
Add to Card
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Technical Information
Catalog Number: AA01EO5Q
Chemical Name: BMS-935177
CAS Number: 1231889-53-4
Molecular Formula: C31H26N4O3
Molecular Weight: 502.5631
MDL Number: MFCD30470964
SMILES: Cc1c(cccc1n1cnc2c(c1=O)cccc2)c1ccc(c2c1c1ccc(cc1[nH]2)C(O)(C)C)C(=O)N
Properties
Complexity: 951  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 38  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 3  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4.5  
Literature fold

Title: Discovery of 6-Fluoro-5-(R)-(3-(S)-(8-fluoro-1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-2-methylphenyl)-2-(S)-(2-hydroxypropan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole-8-carboxamide (BMS-986142): A Reversible Inhibitor of Bruton's Tyrosine Kinase (BTK) Conformationally Constrained by Two Locked Atropisomers.

Journal: Journal of medicinal chemistry20161013

Title: The effect of acid treatment upon the susceptibility of rabbit IgG to proteolytic cleavage with various enzymes.

Journal: Immunochemistry19750801

Title: De Lucca GV, et al. Small Molecule Reversible Inhibitors of Bruton's Tyrosine Kinase (BTK): Structure-Activity Relationships Leading to the Identification of 7-(2-Hydroxypropan-2-yl)-4--methyl-3-(4-oxo-3,4-dihydroquinazolin-3-yl)phenyl-9H-carbazole-1-carboxamide (BMS-935177). J Med Chem. 2016 Sep 8;59(17):7915-35.

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