N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid
TL;DR: N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid (CAS 403-80-5) is a chemical compound with molecular formula C12H12ClN3O2 and molecular weight 265.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-(4,5-dimethyl-1,3-oxazol-2-yl)urea
Also Known As: N-(4-Chlorophenyl)-N'-(4,5-dimethyl-2-oxazolyl)urea, 1-(4-chlorophenyl)-3-(4,5-dimethyl-1,3-oxazol-2-yl)urea, 1-(4-chloro-phenyl)-3-(4,5-dimethyl-oxazol-2-yl)-urea, 1-(4-Chlorophenyl)-3-(4,5-dimethyloxazol-2-yl)urea, Urea, N-(4-chlorophenyl)-N'-(4,5-dimethyl-2-oxazolyl)-
| Molecular Formula | C12H12ClN3O2 |
|---|---|
| Molecular Weight | 265.06 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.0618 |
| Heavy Atoms | 18 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 403-80-5 |
|---|---|
| SMILES | CC1=C(OC(=N1)NC(=O)NC2=CC=C(C=C2)Cl)C |
| InChIKey | SZBNCETWJZYQIZ-UHFFFAOYSA-N |
Product Overview
N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid (CAS 403-80-5), with molecular formula C12H12ClN3O2 and molecular weight 265.06 g/mol. IUPAC: 1-(4-chlorophenyl)-3-(4,5-dimethyl-1,3-oxazol-2-yl)urea.
Chemical Property Profile of N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid
Property Insights of N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid. Following Lipinski's Rule of Five, N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid has 2 hydrogen bond donor(s) and 3 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 N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid?
The CAS number of N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid is 403-80-5.
What is the molecular formula of N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid?
The molecular formula of N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid is C12H12ClN3O2.
What is the molecular weight of N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid?
The molecular weight of N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid is 265.06 g/mol.
Where can I buy N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid?
You can request a quote for N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Chlorophenyl)-N'-(4,5-dimethyl-1,3-oxazol-2-yl)carbamimidic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.