Home Amines 1408238-40-3
1408238-40-3,MFCD27996077
Catalog No.:AA001CSA

1408238-40-3 | β-Alanine, N-[[2-[[[4-[[[(hexyloxy)carbonyl]amino]carbonyl]phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-2-pyridinyl-, ethyl ester

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50mg
95%
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$160.00   $112.00
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Technical Information
Catalog Number:
AA001CSA
Chemical Name:
β-Alanine, N-[[2-[[[4-[[[(hexyloxy)carbonyl]amino]carbonyl]phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-2-pyridinyl-, ethyl ester
CAS Number:
1408238-40-3
Molecular Formula:
C34H40N6O6
Molecular Weight:
628.7180
MDL Number:
MFCD27996077
SMILES:
CCCCCCOC(=O)NC(=O)c1ccc(cc1)NCc1nc2c(n1C)ccc(c2)C(=O)N(c1ccccn1)CCC(=O)OCC
Properties
Computed Properties
 
Complexity:
991  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
46  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
17  
XLogP3:
5.2  

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Tags:1408238-40-3 Molecular Formula|1408238-40-3 MDL|1408238-40-3 SMILES|1408238-40-3 β-Alanine, N-[[2-[[[4-[[[(hexyloxy)carbonyl]amino]carbonyl]phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-2-pyridinyl-, ethyl ester