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Home Other Building Blocks 13187-06-9
13187-06-9,MFCD00079242
Catalog No.:AA000ZSD

13187-06-9 | Piperidine, 1-methyl-4-(9H-thioxanthen-9-ylidene)-, (2Z)-2-butenedioate (1:1)

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25mg
97%
in stock  
$304.00   $213.00
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Technical Information
Catalog Number:
AA000ZSD
Chemical Name:
Piperidine, 1-methyl-4-(9H-thioxanthen-9-ylidene)-, (2Z)-2-butenedioate (1:1)
CAS Number:
13187-06-9
Molecular Formula:
C23H23NO4S
Molecular Weight:
409.4980
MDL Number:
MFCD00079242
SMILES:
CN1CCC(=C2c3ccccc3Sc3c2cccc3)CC1.OC(=O)/C=C\C(=O)O
NSC Number:
757828
Properties
Computed Properties
 
Complexity:
501  
Covalently-Bonded Unit Count:
2  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
2  

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Schmitz B, et al. BF-1--a novel selective 5-HT2B receptor antagonist blocking neurogenic dural plasma protein extravasation in guinea pigs. Eur J Pharmacol. 2015 Mar 15;751:73-80.

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SDS
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Tags:13187-06-9 Molecular Formula|13187-06-9 MDL|13187-06-9 SMILES|13187-06-9 Piperidine, 1-methyl-4-(9H-thioxanthen-9-ylidene)-, (2Z)-2-butenedioate (1:1)