BAS 01067065
TL;DR: BAS 01067065 (CAS 334503-53-6) is a chemical compound with molecular formula C18H17FN2O3S2 and molecular weight 392.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(2-fluorobenzoyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: BAS 01067065, methyl 2-(3-(2-fluorobenzoyl)thioureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, methyl 2-({[(2-fluorophenyl)carbonyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, methyl 2-[(2-fluorobenzoyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C18H17FN2O3S2 |
|---|---|
| Molecular Weight | 392.07 g/mol |
| LogP | 3.6794 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 392.06647 |
| Heavy Atoms | 26 |
| Complexity | 879.3163 |
Chemical Identifiers
| CAS Number | 334503-53-6 |
|---|---|
| SMILES | COC(=O)C1=C(SC2=C1CCCC2)NC(=S)NC(=O)C3=CC=CC=C3F |
Product Overview
BAS 01067065 (CAS 334503-53-6), with molecular formula C18H17FN2O3S2 and molecular weight 392.07 g/mol. IUPAC: methyl 2-[(2-fluorobenzoyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of BAS 01067065
Property Insights of BAS 01067065
The XLogP value of 3.6794 indicates that BAS 01067065 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 BAS 01067065. Following Lipinski's Rule of Five, BAS 01067065 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 BAS 01067065?
The CAS number of BAS 01067065 is 334503-53-6.
What is the molecular formula of BAS 01067065?
The molecular formula of BAS 01067065 is C18H17FN2O3S2.
What is the molecular weight of BAS 01067065?
The molecular weight of BAS 01067065 is 392.07 g/mol.
Where can I buy BAS 01067065?
You can request a quote for BAS 01067065 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01067065?
Yes, KEHONG BIO provides custom synthesis services for BAS 01067065 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.