3-(3-Chlorophenyl)-1,1-diisopropylurea
TL;DR: 3-(3-Chlorophenyl)-1,1-diisopropylurea (CAS 82744-86-3) is a chemical compound with molecular formula C13H19ClN2O and molecular weight 254.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chlorophenyl)-1,1-di(propan-2-yl)urea
Also Known As: 3-(3-Chlorophenyl)-1,1-diisopropylurea, N'-(3-CHLOROPHENYL)-N,N-DIISOPROPYLUREA, 1-(3-Chlorophenyl)-3,3-diisopropylurea, 3-(3-chlorophenyl)-1,1-di(propan-2-yl)urea, 1-(3-chlorophenyl)-3,3-bis(propan-2-yl)urea
| Molecular Formula | C13H19ClN2O |
|---|---|
| Molecular Weight | 254.12 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 254.11859 |
| Heavy Atoms | 17 |
| Complexity | 248.0 |
Chemical Identifiers
| CAS Number | 82744-86-3 |
|---|---|
| SMILES | CC(C)N(C(C)C)C(=O)NC1=CC(=CC=C1)Cl |
| InChIKey | DCLJPFHSPJTWOC-UHFFFAOYSA-N |
Product Overview
3-(3-Chlorophenyl)-1,1-diisopropylurea (CAS 82744-86-3), with molecular formula C13H19ClN2O and molecular weight 254.12 g/mol. IUPAC: 3-(3-chlorophenyl)-1,1-di(propan-2-yl)urea.
Chemical Property Profile of 3-(3-Chlorophenyl)-1,1-diisopropylurea
Property Insights of 3-(3-Chlorophenyl)-1,1-diisopropylurea
The XLogP value of 3.6 indicates that 3-(3-Chlorophenyl)-1,1-diisopropylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, 3-(3-Chlorophenyl)-1,1-diisopropylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Chlorophenyl)-1,1-diisopropylurea has 1 hydrogen bond donor(s) and 1 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 3-(3-Chlorophenyl)-1,1-diisopropylurea?
The CAS number of 3-(3-Chlorophenyl)-1,1-diisopropylurea is 82744-86-3.
What is the molecular formula of 3-(3-Chlorophenyl)-1,1-diisopropylurea?
The molecular formula of 3-(3-Chlorophenyl)-1,1-diisopropylurea is C13H19ClN2O.
What is the molecular weight of 3-(3-Chlorophenyl)-1,1-diisopropylurea?
The molecular weight of 3-(3-Chlorophenyl)-1,1-diisopropylurea is 254.12 g/mol.
Where can I buy 3-(3-Chlorophenyl)-1,1-diisopropylurea?
You can request a quote for 3-(3-Chlorophenyl)-1,1-diisopropylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Chlorophenyl)-1,1-diisopropylurea?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Chlorophenyl)-1,1-diisopropylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.