![N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide structure](/static/products/871/871806-78-9.png)
N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide
TL;DR: N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide (CAS 871806-78-9) is a chemical compound with molecular formula C19H17ClN4OS and molecular weight 384.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-chloropyridine-3-carboxamide
Also Known As: N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide, N-(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-chloropyridine-3-carboxamide, N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[5,4-c]pyridin-2-yl}-6-chloropyridine-3-carboxamide
| Molecular Formula | C19H17ClN4OS |
|---|---|
| Molecular Weight | 384.08 g/mol |
| LogP | 4.0021 |
| Topological Polar Surface Area | 58.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 384.08115 |
| Heavy Atoms | 26 |
| Complexity | 911.0484 |
Chemical Identifiers
| CAS Number | 871806-78-9 |
|---|---|
| SMILES | C1CN(CC2=C1N=C(S2)NC(=O)C3=CN=C(C=C3)Cl)CC4=CC=CC=C4 |
Product Overview
N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide (CAS 871806-78-9), with molecular formula C19H17ClN4OS and molecular weight 384.08 g/mol. IUPAC: N-(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-chloropyridine-3-carboxamide.
Chemical Property Profile of N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide
Property Insights of N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide
The XLogP value of 4.0021 indicates that N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.12 Ų, N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide?
The CAS number of N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide is 871806-78-9.
What is the molecular formula of N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide?
The molecular formula of N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide is C19H17ClN4OS.
What is the molecular weight of N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide?
The molecular weight of N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide is 384.08 g/mol.
Where can I buy N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide?
You can request a quote for N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-benzyl-9-thia-3,7-diazabicyclo[4.3.0]nona-7,10-dien-8-yl)-6-chloro-pyridine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.