N'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-yl)carbamimidic acid
TL;DR: N'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-yl)carbamimidic acid (CAS 10250-66-5) is a chemical compound with molecular formula C12H15ClN2O and molecular weight 238.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroethyl)-3-(2,3-dihydro-1H-inden-5-yl)urea
Also Known As: 1-(2-Chloroethyl)-3-(5-indanyl)urea, Urea, 1-(2-chloroethyl)-3-(5-indanyl)-, 5-[3-(2-chloroethyl)ureido]indane, 1-(5-Indanyl)-3-(2-chloroethyl)urea, 1-(2-Chloroethyl)-3-(indan-5-yl)urea
| Molecular Formula | C12H15ClN2O |
|---|---|
| Molecular Weight | 238.09 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.0873 |
| Heavy Atoms | 16 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 10250-66-5 |
|---|---|
| SMILES | C1CC2=C(C1)C=C(C=C2)NC(=O)NCCCl |
| InChIKey | WUWJEVPZOURBII-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-yl)carbamimidic acid (CAS 10250-66-5), with molecular formula C12H15ClN2O and molecular weight 238.09 g/mol. IUPAC: 1-(2-chloroethyl)-3-(2,3-dihydro-1H-inden-5-yl)urea.
Chemical Property Profile of N'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-yl)carbamimidic acid
Property Insights of N'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-yl)carbamimidic acid
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-yl)carbamimidic acid. With a topological polar surface area (TPSA) of 41.1 Ų, N'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-yl)carbamimidic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-yl)carbamimidic acid has 2 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 N'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-yl)carbamimidic acid?
The CAS number of N'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-yl)carbamimidic acid is 10250-66-5.
What is the molecular formula of N'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-yl)carbamimidic acid?
The molecular formula of N'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-yl)carbamimidic acid is C12H15ClN2O.
What is the molecular weight of N'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-yl)carbamimidic acid?
The molecular weight of N'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-yl)carbamimidic acid is 238.09 g/mol.
Where can I buy N'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-yl)carbamimidic acid?
You can request a quote for N'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-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'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-yl)carbamimidic acid?
Yes, KEHONG BIO provides custom synthesis services for N'-(2-Chloroethyl)-N-(2,3-dihydro-1H-inden-5-yl)carbamimidic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.