BAS 02819962
TL;DR: BAS 02819962 (CAS 425684-29-3) is a chemical compound with molecular formula C23H18N4O4S2 and molecular weight 478.08 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-methylphenyl]carbamothioyl]-4-methoxy-3-nitrobenzamide
Also Known As: BAS 02819962, AB00107463-01, N-[[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]carbamothioyl]-4-methoxy-3-nitrobenzamide, N-{[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]carbamothioyl}-4-methoxy-3-nitrobenzamide, 1-(5-Benzothiazol-2-yl-2-methyl-phenyl)-3-(4-methoxy-3-nitro-benzoyl)-thiourea
| Molecular Formula | C23H18N4O4S2 |
|---|---|
| Molecular Weight | 478.08 g/mol |
| LogP | 5.31532 |
| Topological Polar Surface Area | 106.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 478.07693 |
| Heavy Atoms | 33 |
| Complexity | 1367.4978 |
Chemical Identifiers
| CAS Number | 425684-29-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=S)NC(=O)C4=CC(=C(C=C4)OC)[N+](=O)[O-] |
Product Overview
BAS 02819962 (CAS 425684-29-3), with molecular formula C23H18N4O4S2 and molecular weight 478.08 g/mol. IUPAC: N-[[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]carbamothioyl]-4-methoxy-3-nitrobenzamide.
Chemical Property Profile of BAS 02819962
Property Insights of BAS 02819962
The XLogP value of 5.31532 indicates that BAS 02819962 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.39 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02819962. Following Lipinski's Rule of Five, BAS 02819962 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02819962?
The CAS number of BAS 02819962 is 425684-29-3.
What is the molecular formula of BAS 02819962?
The molecular formula of BAS 02819962 is C23H18N4O4S2.
What is the molecular weight of BAS 02819962?
The molecular weight of BAS 02819962 is 478.08 g/mol.
Where can I buy BAS 02819962?
You can request a quote for BAS 02819962 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02819962?
Yes, KEHONG BIO provides custom synthesis services for BAS 02819962 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.