BIM-0017805.P001
TL;DR: BIM-0017805.P001 (CAS 424815-52-1) is a chemical compound with molecular formula C20H25NO5S and molecular weight 391.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(3-propan-2-yloxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
Also Known As: BIM-0017805.P001, 6-({3-[(propan-2-yloxy)carbonyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}carbamoyl)cyclohex-3-ene-1-carboxylic acid, 6-({[3-(isopropoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothien-2-yl]amino}carbonyl)-3-cyclohexene-1-carboxylic acid, 6-[(3-propan-2-yloxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid, benzo[b]thiophene-3-carboxylic acid, 2-[[(6-carboxy-3-cyclohexen-1-yl)carbonyl]amino]-4,5,6,7-tetrahydro-, 3-(1-methylethyl) ester
| Molecular Formula | C20H25NO5S |
|---|---|
| Molecular Weight | 391.15 g/mol |
| LogP | 3.7976 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 391.14536 |
| Heavy Atoms | 27 |
| Complexity | 779.5802 |
Chemical Identifiers
| CAS Number | 424815-52-1 |
|---|---|
| SMILES | CC(C)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3CC=CCC3C(=O)O |
Product Overview
BIM-0017805.P001 (CAS 424815-52-1), with molecular formula C20H25NO5S and molecular weight 391.15 g/mol. IUPAC: 6-[(3-propan-2-yloxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid.
Chemical Property Profile of BIM-0017805.P001
Property Insights of BIM-0017805.P001
The XLogP value of 3.7976 indicates that BIM-0017805.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0017805.P001. Following Lipinski's Rule of Five, BIM-0017805.P001 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 BIM-0017805.P001?
The CAS number of BIM-0017805.P001 is 424815-52-1.
What is the molecular formula of BIM-0017805.P001?
The molecular formula of BIM-0017805.P001 is C20H25NO5S.
What is the molecular weight of BIM-0017805.P001?
The molecular weight of BIM-0017805.P001 is 391.15 g/mol.
Where can I buy BIM-0017805.P001?
You can request a quote for BIM-0017805.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0017805.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0017805.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.