RefChem:1081047
TL;DR: RefChem:1081047 (CAS 20131-73-1) is a chemical compound with molecular formula C19H29ClN2O2 and molecular weight 352.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-pyrrolidin-1-ium-1-ylcyclohexyl) N-(2,6-dimethylphenyl)carbamate chloride
Also Known As: K 1502, 2,6-Dimethylcarbanilic acid 2-(1-pyrrolidinyl)cyclohexyl ester hydrochloride, 2-(1-Pyrrolidinyl)cyclohexyl 2,6-dimethylcarbanilate hydrochloride, Carbanilic acid, 2,6-dimethyl-, 2-(1-pyrrolidinyl)cyclohexyl ester, hydrochloride, (2-Pyrrolidin-1-ium-1-ylcyclohexyl)n-(2,6-dimethylphenyl)carbamatechloride
| Molecular Formula | C19H29ClN2O2 |
|---|---|
| Molecular Weight | 352.19 g/mol |
| LogP | -0.15 |
| Topological Polar Surface Area | 42.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 352.19174 |
| Heavy Atoms | 24 |
| Complexity | 385.0 |
Chemical Identifiers
| CAS Number | 20131-73-1 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)OC2CCCCC2[NH+]3CCCC3.[Cl-] |
| InChIKey | NKEUWTKDNALYBL-UHFFFAOYSA-N |
Product Overview
RefChem:1081047 (CAS 20131-73-1), with molecular formula C19H29ClN2O2 and molecular weight 352.19 g/mol. IUPAC: (2-pyrrolidin-1-ium-1-ylcyclohexyl) N-(2,6-dimethylphenyl)carbamate chloride.
Chemical Property Profile of RefChem:1081047
Property Insights of RefChem:1081047
The XLogP value of -0.15 indicates that RefChem:1081047 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.8 Ų, RefChem:1081047 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1081047 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 RefChem:1081047?
The CAS number of RefChem:1081047 is 20131-73-1.
What is the molecular formula of RefChem:1081047?
The molecular formula of RefChem:1081047 is C19H29ClN2O2.
What is the molecular weight of RefChem:1081047?
The molecular weight of RefChem:1081047 is 352.19 g/mol.
Where can I buy RefChem:1081047?
You can request a quote for RefChem:1081047 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1081047?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1081047 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.