BAS 00803293
TL;DR: BAS 00803293 (CAS 307339-49-7) is a chemical compound with molecular formula C17H16N2O4S and molecular weight 344.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]benzoic acid
Also Known As: BAS 00803293, 2-({[3-(aminocarbonyl)-4,5,6,7-tetrahydro-1-benzothien-2-yl]amino}carbonyl)benzoic acid, 2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]benzoic acid, N-(3-Carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-yl)-phthalamic acid, 2-[N-(3-carbamoyl-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)carbamoyl]benzoic ac id
| Molecular Formula | C17H16N2O4S |
|---|---|
| Molecular Weight | 344.08 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.08307 |
| Heavy Atoms | 24 |
| Complexity | 527.0 |
Chemical Identifiers
| CAS Number | 307339-49-7 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC=C3C(=O)O)C(=O)N |
| InChIKey | AUYQDVZUNURNSO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
BAS 00803293 (CAS 307339-49-7), with molecular formula C17H16N2O4S and molecular weight 344.08 g/mol. IUPAC: 2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]benzoic acid.
Chemical Property Profile of BAS 00803293
Property Insights of BAS 00803293
The XLogP value of 3.0 indicates that BAS 00803293 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00803293. Following Lipinski's Rule of Five, BAS 00803293 has 3 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 BAS 00803293?
The CAS number of BAS 00803293 is 307339-49-7.
What is the molecular formula of BAS 00803293?
The molecular formula of BAS 00803293 is C17H16N2O4S.
What is the molecular weight of BAS 00803293?
The molecular weight of BAS 00803293 is 344.08 g/mol.
Where can I buy BAS 00803293?
You can request a quote for BAS 00803293 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00803293?
Yes, KEHONG BIO provides custom synthesis services for BAS 00803293 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.