BAS 05160950
TL;DR: BAS 05160950 (CAS 313703-34-3) is a chemical compound with molecular formula C15H14N2O3S and molecular weight 302.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(pyridine-4-carbonylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: BAS 05160950, methyl 2-(isonicotinoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, methyl 2-(pyridine-4-carbonylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, methyl 2-(4-pyridylcarbonylamino)-4,5,6-trihydrocyclopenta[2,1-b]thiophene-3-c arboxylate, methyl 2-(isonicotinamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
| Molecular Formula | C15H14N2O3S |
|---|---|
| Molecular Weight | 302.07 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 96.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.0725 |
| Heavy Atoms | 21 |
| Complexity | 412.0 |
Chemical Identifiers
| CAS Number | 313703-34-3 |
|---|---|
| SMILES | COC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC=NC=C3 |
| InChIKey | VJMSVPJTTIDIPT-UHFFFAOYSA-N |
Product Overview
BAS 05160950 (CAS 313703-34-3), with molecular formula C15H14N2O3S and molecular weight 302.07 g/mol. IUPAC: methyl 2-(pyridine-4-carbonylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of BAS 05160950
Property Insights of BAS 05160950
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 05160950. The TPSA of 96.5 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05160950. Following Lipinski's Rule of Five, BAS 05160950 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 BAS 05160950?
The CAS number of BAS 05160950 is 313703-34-3.
What is the molecular formula of BAS 05160950?
The molecular formula of BAS 05160950 is C15H14N2O3S.
What is the molecular weight of BAS 05160950?
The molecular weight of BAS 05160950 is 302.07 g/mol.
Where can I buy BAS 05160950?
You can request a quote for BAS 05160950 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05160950?
Yes, KEHONG BIO provides custom synthesis services for BAS 05160950 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.