BAS 02818694
TL;DR: BAS 02818694 (CAS 428451-03-0) is a chemical compound with molecular formula C23H18ClN3O3S2 and molecular weight 483.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]carbamothioyl]-3,4-dimethoxybenzamide
Also Known As: BAS 02818694, N-[[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]carbamothioyl]-3,4-dimethoxybenzamide, 1-(5-Benzothiazol-2-yl-2-chloro-phenyl)-3-(3,4-dimethoxy-benzoyl)-thiourea, N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-N'-(3,4-dimethoxybenzoyl)thiourea, N-{[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]carbamothioyl}-3,4-dimethoxybenzamide
| Molecular Formula | C23H18ClN3O3S2 |
|---|---|
| Molecular Weight | 483.05 g/mol |
| LogP | 5.7607 |
| Topological Polar Surface Area | 72.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 483.04782 |
| Heavy Atoms | 32 |
| Complexity | 1290.093 |
Chemical Identifiers
| CAS Number | 428451-03-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C3=NC4=CC=CC=C4S3)Cl)OC |
Product Overview
BAS 02818694 (CAS 428451-03-0), with molecular formula C23H18ClN3O3S2 and molecular weight 483.05 g/mol. IUPAC: N-[[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]carbamothioyl]-3,4-dimethoxybenzamide.
Chemical Property Profile of BAS 02818694
Property Insights of BAS 02818694
The XLogP value of 5.7607 indicates that BAS 02818694 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.48 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02818694. Following Lipinski's Rule of Five, BAS 02818694 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02818694?
The CAS number of BAS 02818694 is 428451-03-0.
What is the molecular formula of BAS 02818694?
The molecular formula of BAS 02818694 is C23H18ClN3O3S2.
What is the molecular weight of BAS 02818694?
The molecular weight of BAS 02818694 is 483.05 g/mol.
Where can I buy BAS 02818694?
You can request a quote for BAS 02818694 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02818694?
Yes, KEHONG BIO provides custom synthesis services for BAS 02818694 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.