4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide
TL;DR: 4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide (CAS 524693-02-5) is a chemical compound with molecular formula C24H26N4O2S and molecular weight 434.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzyl-2-[[4-(dimethylamino)benzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide
Also Known As: 4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide, 6-Benzyl-2-(4-(dimethylamino)benzamido)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide, 6-benzyl-2-[[4-(dimethylamino)benzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide
| Molecular Formula | C24H26N4O2S |
|---|---|
| Molecular Weight | 434.18 g/mol |
| LogP | 3.7236 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 434.17764 |
| Heavy Atoms | 31 |
| Complexity | 1090.772 |
Chemical Identifiers
| CAS Number | 524693-02-5 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C(=O)NC2=C(C3=C(S2)CN(CC3)CC4=CC=CC=C4)C(=O)N |
Product Overview
4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide (CAS 524693-02-5), with molecular formula C24H26N4O2S and molecular weight 434.18 g/mol. IUPAC: 6-benzyl-2-[[4-(dimethylamino)benzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide.
Chemical Property Profile of 4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide
Property Insights of 4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide
The XLogP value of 3.7236 indicates that 4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide. Following Lipinski's Rule of Five, 4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide has 2 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 4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide?
The CAS number of 4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide is 524693-02-5.
What is the molecular formula of 4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide?
The molecular formula of 4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide is C24H26N4O2S.
What is the molecular weight of 4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide?
The molecular weight of 4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide is 434.18 g/mol.
Where can I buy 4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide?
You can request a quote for 4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-benzyl-8-[(4-dimethylaminobenzoyl)amino]-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.