N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid
TL;DR: N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid (CAS 76267-24-8) is a chemical compound with molecular formula C12H17N3O2 and molecular weight 235.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-carbamoyl-3-(2-methylphenyl)-1-propan-2-ylurea
Also Known As: 1-Isopropyl-3-methyl-5-phenylbiuret, 1-methyl-1-(phenylcarbamoyl)-3-propan-2-ylurea, N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid, 1-carbamoyl-3-(2-methylphenyl)-1-propan-2-ylurea, 2-Methyl-N-(1-methylethyl)-N'-phenylimidodicarbonic diamide
| Molecular Formula | C12H17N3O2 |
|---|---|
| Molecular Weight | 235.13 g/mol |
| LogP | 2.31602 |
| Topological Polar Surface Area | 75.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.13208 |
| Heavy Atoms | 17 |
| Complexity | 429.51385 |
Chemical Identifiers
| CAS Number | 76267-24-8 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)N(C(C)C)C(=O)N |
Product Overview
N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid (CAS 76267-24-8), with molecular formula C12H17N3O2 and molecular weight 235.13 g/mol. IUPAC: 1-carbamoyl-3-(2-methylphenyl)-1-propan-2-ylurea.
Chemical Property Profile of N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid
Property Insights of N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid
The XLogP value of 2.31602 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid. The TPSA of 75.43 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid. Following Lipinski's Rule of Five, N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid has 2 hydrogen bond donor(s) and 2 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-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid?
The CAS number of N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid is 76267-24-8.
What is the molecular formula of N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid?
The molecular formula of N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid is C12H17N3O2.
What is the molecular weight of N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid?
The molecular weight of N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid is 235.13 g/mol.
Where can I buy N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid?
You can request a quote for N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Methylphenyl)-N-propan-2-yltriimidodicarbonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.