BAS 02052740
TL;DR: BAS 02052740 (CAS 332874-45-0) is a chemical compound with molecular formula C20H20ClNO3S2 and molecular weight 421.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4-ethyl-5-methylthiophene-3-carboxylate
Also Known As: BAS 02052740, isopropyl 2-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}-4-ethyl-5-methyl-3-thiophenecarboxylate, propan-2-yl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4-ethyl-5-methylthiophene-3-carboxylate, ISOPROPYL 2-(3-CHLORO-1-BENZOTHIOPHENE-2-AMIDO)-4-ETHYL-5-METHYLTHIOPHENE-3-CARBOXYLATE, isopropyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-ethyl-5-methylthiophene-3-carboxylate
| Molecular Formula | C20H20ClNO3S2 |
|---|---|
| Molecular Weight | 421.06 g/mol |
| LogP | 6.30452 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.0573 |
| Heavy Atoms | 27 |
| Complexity | 1019.8257 |
Chemical Identifiers
| CAS Number | 332874-45-0 |
|---|---|
| SMILES | CCC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C |
Product Overview
BAS 02052740 (CAS 332874-45-0), with molecular formula C20H20ClNO3S2 and molecular weight 421.06 g/mol. IUPAC: propan-2-yl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4-ethyl-5-methylthiophene-3-carboxylate.
Chemical Property Profile of BAS 02052740
Property Insights of BAS 02052740
The XLogP value of 6.30452 indicates that BAS 02052740 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, BAS 02052740 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 02052740 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02052740?
The CAS number of BAS 02052740 is 332874-45-0.
What is the molecular formula of BAS 02052740?
The molecular formula of BAS 02052740 is C20H20ClNO3S2.
What is the molecular weight of BAS 02052740?
The molecular weight of BAS 02052740 is 421.06 g/mol.
Where can I buy BAS 02052740?
You can request a quote for BAS 02052740 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02052740?
Yes, KEHONG BIO provides custom synthesis services for BAS 02052740 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.