BIM-0036356.P001
TL;DR: BIM-0036356.P001 (CAS 370575-48-7) is a chemical compound with molecular formula C20H21FN2O3S2 and molecular weight 420.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(4-fluorobenzoyl)carbamothioylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Also Known As: BIM-0036356.P001, ethyl 2-[(4-fluorobenzoyl)carbamothioylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate, ethyl 2-({[(4-fluorophenyl)carbonyl]carbamothioyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate, ethyl 2-(3-(4-fluorobenzoyl)thioureido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
| Molecular Formula | C20H21FN2O3S2 |
|---|---|
| Molecular Weight | 420.10 g/mol |
| LogP | 4.4596 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 420.09775 |
| Heavy Atoms | 28 |
| Complexity | 893.6009 |
Chemical Identifiers
| CAS Number | 370575-48-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=S)NC(=O)C3=CC=C(C=C3)F |
Product Overview
BIM-0036356.P001 (CAS 370575-48-7), with molecular formula C20H21FN2O3S2 and molecular weight 420.10 g/mol. IUPAC: ethyl 2-[(4-fluorobenzoyl)carbamothioylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate.
Chemical Property Profile of BIM-0036356.P001
Property Insights of BIM-0036356.P001
The XLogP value of 4.4596 indicates that BIM-0036356.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0036356.P001. Following Lipinski's Rule of Five, BIM-0036356.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-0036356.P001?
The CAS number of BIM-0036356.P001 is 370575-48-7.
What is the molecular formula of BIM-0036356.P001?
The molecular formula of BIM-0036356.P001 is C20H21FN2O3S2.
What is the molecular weight of BIM-0036356.P001?
The molecular weight of BIM-0036356.P001 is 420.10 g/mol.
Where can I buy BIM-0036356.P001?
You can request a quote for BIM-0036356.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0036356.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0036356.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.