BAS 02820945
TL;DR: BAS 02820945 (CAS 6408-60-2) is a chemical compound with molecular formula C23H18ClN3O3S and molecular weight 451.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-2-methoxybenzamide
Also Known As: BAS 02820945, N-[[3-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-2-methoxybenzamide, N-[[3-(5-CHLOROBENZOOXAZOL-2-YL)-2-METHYL-PHENYL]THIOCARBAMOYL]-2-METHOXY-BENZAMIDE, N-{[3-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl}-2-methoxybenzamide, N-[3-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-N'-(2-methoxybenzoyl)thiourea
| Molecular Formula | C23H18ClN3O3S |
|---|---|
| Molecular Weight | 451.08 g/mol |
| LogP | 5.59202 |
| Topological Polar Surface Area | 76.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 451.07574 |
| Heavy Atoms | 31 |
| Complexity | 1302.4713 |
Chemical Identifiers
| CAS Number | 6408-60-2 |
|---|---|
| SMILES | CC1=C(C=CC=C1NC(=S)NC(=O)C2=CC=CC=C2OC)C3=NC4=C(O3)C=CC(=C4)Cl |
Product Overview
BAS 02820945 (CAS 6408-60-2), with molecular formula C23H18ClN3O3S and molecular weight 451.08 g/mol. IUPAC: N-[[3-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-2-methoxybenzamide.
Chemical Property Profile of BAS 02820945
Property Insights of BAS 02820945
The XLogP value of 5.59202 indicates that BAS 02820945 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.39 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02820945. Following Lipinski's Rule of Five, BAS 02820945 has 2 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 02820945?
The CAS number of BAS 02820945 is 6408-60-2.
What is the molecular formula of BAS 02820945?
The molecular formula of BAS 02820945 is C23H18ClN3O3S.
What is the molecular weight of BAS 02820945?
The molecular weight of BAS 02820945 is 451.08 g/mol.
Where can I buy BAS 02820945?
You can request a quote for BAS 02820945 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02820945?
Yes, KEHONG BIO provides custom synthesis services for BAS 02820945 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.