1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea
TL;DR: 1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea (CAS 333740-64-0) is a chemical compound with molecular formula C22H17N3O2S and molecular weight 387.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-(1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2-methylbenzamide
Also Known As: BAS 02820708, 1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea, N-[[3-(1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2-methylbenzamide, N-[3-(1,3-benzoxazol-2-yl)phenyl]-N'-(2-methylbenzoyl)thiourea, N-{[3-(1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-2-methylbenzamide
| Molecular Formula | C22H17N3O2S |
|---|---|
| Molecular Weight | 387.10 g/mol |
| LogP | 4.93002 |
| Topological Polar Surface Area | 67.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 387.10416 |
| Heavy Atoms | 28 |
| Complexity | 1150.1041 |
Chemical Identifiers
| CAS Number | 333740-64-0 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4O3 |
Product Overview
1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea (CAS 333740-64-0), with molecular formula C22H17N3O2S and molecular weight 387.10 g/mol. IUPAC: N-[[3-(1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2-methylbenzamide.
Chemical Property Profile of 1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea
Property Insights of 1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea
The XLogP value of 4.93002 indicates that 1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea 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 1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea. Following Lipinski's Rule of Five, 1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea?
The CAS number of 1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea is 333740-64-0.
What is the molecular formula of 1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea?
The molecular formula of 1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea is C22H17N3O2S.
What is the molecular weight of 1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea?
The molecular weight of 1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea is 387.10 g/mol.
Where can I buy 1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea?
You can request a quote for 1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Benzooxazol-2-yl-phenyl)-3-(2-methyl-benzoyl)-thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.