BIM-0046104.P001
TL;DR: BIM-0046104.P001 (CAS 378772-87-3) is a chemical compound with molecular formula C23H17Cl2N3O2S and molecular weight 469.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]benzamide
Also Known As: BIM-0046104.P001, 2-chloro-N-[[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]benzamide, 2-chloro-N-((4-chloro-3-(5,6-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)benzamide, 2-chloro-N-{[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}benzamide
| Molecular Formula | C23H17Cl2N3O2S |
|---|---|
| Molecular Weight | 469.04 g/mol |
| LogP | 6.54524 |
| Topological Polar Surface Area | 67.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 469.04184 |
| Heavy Atoms | 31 |
| Complexity | 1294.9033 |
Chemical Identifiers
| CAS Number | 378772-87-3 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)OC(=N2)C3=C(C=CC(=C3)NC(=S)NC(=O)C4=CC=CC=C4Cl)Cl |
Product Overview
BIM-0046104.P001 (CAS 378772-87-3), with molecular formula C23H17Cl2N3O2S and molecular weight 469.04 g/mol. IUPAC: 2-chloro-N-[[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]benzamide.
Chemical Property Profile of BIM-0046104.P001
Property Insights of BIM-0046104.P001
The XLogP value of 6.54524 indicates that BIM-0046104.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.16 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0046104.P001. Following Lipinski's Rule of Five, BIM-0046104.P001 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0046104.P001?
The CAS number of BIM-0046104.P001 is 378772-87-3.
What is the molecular formula of BIM-0046104.P001?
The molecular formula of BIM-0046104.P001 is C23H17Cl2N3O2S.
What is the molecular weight of BIM-0046104.P001?
The molecular weight of BIM-0046104.P001 is 469.04 g/mol.
Where can I buy BIM-0046104.P001?
You can request a quote for BIM-0046104.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0046104.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0046104.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.