BAS 02818722
TL;DR: BAS 02818722 (CAS 335213-89-3) is a chemical compound with molecular formula C26H25N3O4S and molecular weight 475.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3,4-dimethoxybenzamide
Also Known As: BAS 02818722, N-(3,4-dimethoxybenzoyl)-N'-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]thiourea, N-[[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3,4-dimethoxybenzamide
| Molecular Formula | C26H25N3O4S |
|---|---|
| Molecular Weight | 475.16 g/mol |
| LogP | 5.56406 |
| Topological Polar Surface Area | 85.62 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 475.1566 |
| Heavy Atoms | 34 |
| Complexity | 1410.9407 |
Chemical Identifiers
| CAS Number | 335213-89-3 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)N=C(O2)C3=C(C(=CC=C3)NC(=S)NC(=O)C4=CC(=C(C=C4)OC)OC)C)C |
Product Overview
BAS 02818722 (CAS 335213-89-3), with molecular formula C26H25N3O4S and molecular weight 475.16 g/mol. IUPAC: N-[[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3,4-dimethoxybenzamide.
Chemical Property Profile of BAS 02818722
Property Insights of BAS 02818722
The XLogP value of 5.56406 indicates that BAS 02818722 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.62 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02818722. Following Lipinski's Rule of Five, BAS 02818722 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 02818722?
The CAS number of BAS 02818722 is 335213-89-3.
What is the molecular formula of BAS 02818722?
The molecular formula of BAS 02818722 is C26H25N3O4S.
What is the molecular weight of BAS 02818722?
The molecular weight of BAS 02818722 is 475.16 g/mol.
Where can I buy BAS 02818722?
You can request a quote for BAS 02818722 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02818722?
Yes, KEHONG BIO provides custom synthesis services for BAS 02818722 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.