BAS 00401681
TL;DR: BAS 00401681 (CAS 340982-95-8) is a chemical compound with molecular formula C15H13N3O3 and molecular weight 283.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)pyridine-3-carboxamide
Also Known As: BAS 00401681, A1538/0066869, N-(3,5-dioxo-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-4-yl)nicotinamide, N-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)pyridine-3-carboxamide, N-(3,5-Dioxo-4-aza-tricyclo[5.2.1.0*2,6*]dec-8-en-4-yl)-nicotinamide
| Molecular Formula | C15H13N3O3 |
|---|---|
| Molecular Weight | 283.10 g/mol |
| LogP | 0.5335 |
| Topological Polar Surface Area | 79.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 283.0957 |
| Heavy Atoms | 21 |
| Complexity | 640.0012 |
Chemical Identifiers
| CAS Number | 340982-95-8 |
|---|---|
| SMILES | C1C2C=CC1C3C2C(=O)N(C3=O)NC(=O)C4=CN=CC=C4 |
Product Overview
BAS 00401681 (CAS 340982-95-8), with molecular formula C15H13N3O3 and molecular weight 283.10 g/mol. IUPAC: N-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)pyridine-3-carboxamide.
Chemical Property Profile of BAS 00401681
Property Insights of BAS 00401681
The XLogP value of 0.5335 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00401681. The TPSA of 79.37 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00401681. Following Lipinski's Rule of Five, BAS 00401681 has 1 hydrogen bond donor(s) and 4 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 BAS 00401681?
The CAS number of BAS 00401681 is 340982-95-8.
What is the molecular formula of BAS 00401681?
The molecular formula of BAS 00401681 is C15H13N3O3.
What is the molecular weight of BAS 00401681?
The molecular weight of BAS 00401681 is 283.10 g/mol.
Where can I buy BAS 00401681?
You can request a quote for BAS 00401681 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00401681?
Yes, KEHONG BIO provides custom synthesis services for BAS 00401681 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.