BAS 00486936
TL;DR: BAS 00486936 (CAS 5581-56-6) is a chemical compound with molecular formula C20H18N2O3S and molecular weight 366.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[(2-methylphenyl)carbamoyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]furan-2-carboxamide
Also Known As: BAS 00486936, N-{3-[(2-methylphenyl)carbamoyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl}furan-2-carboxamide, N-[3-[(2-methylphenyl)carbamoyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]furan-2-carboxamide, N-(3-{[(2-methylphenyl)amino]carbonyl}-5,6-dihydro-4H-cyclopenta[b]thien-2-yl)-2-furamide, N-[3-(2-toluidinocarbonyl)-5,6-dihydro-4H-cyclopenta[b]thien-2-yl]-2-furamide
| Molecular Formula | C20H18N2O3S |
|---|---|
| Molecular Weight | 366.10 g/mol |
| LogP | 4.64282 |
| Topological Polar Surface Area | 71.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 366.10382 |
| Heavy Atoms | 26 |
| Complexity | 973.1152 |
Chemical Identifiers
| CAS Number | 5581-56-6 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCC3)NC(=O)C4=CC=CO4 |
Product Overview
BAS 00486936 (CAS 5581-56-6), with molecular formula C20H18N2O3S and molecular weight 366.10 g/mol. IUPAC: N-[3-[(2-methylphenyl)carbamoyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]furan-2-carboxamide.
Chemical Property Profile of BAS 00486936
Property Insights of BAS 00486936
The XLogP value of 4.64282 indicates that BAS 00486936 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.34 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00486936. Following Lipinski's Rule of Five, BAS 00486936 has 2 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 00486936?
The CAS number of BAS 00486936 is 5581-56-6.
What is the molecular formula of BAS 00486936?
The molecular formula of BAS 00486936 is C20H18N2O3S.
What is the molecular weight of BAS 00486936?
The molecular weight of BAS 00486936 is 366.10 g/mol.
Where can I buy BAS 00486936?
You can request a quote for BAS 00486936 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00486936?
Yes, KEHONG BIO provides custom synthesis services for BAS 00486936 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.