Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate
TL;DR: Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate (CAS 5659-61-0) is a chemical compound with molecular formula C13H18N2O4 and molecular weight 266.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(ethoxycarbonylamino)propyl N-phenylcarbamate
Also Known As: Ethyl (3-hydroxypropyl)carbamate carbanilate, 3-(ethoxycarbonylamino)propyl N-phenylcarbamate, CARBAMIC ACID, (3-HYDROXYPROPYL)-, ETHYL ESTER, CARBANILATE, 3-[(Ethoxycarbonyl)amino]propyl phenylcarbamate, BRN 2752042
| Molecular Formula | C13H18N2O4 |
|---|---|
| Molecular Weight | 266.13 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 266.12665 |
| Heavy Atoms | 19 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 5659-61-0 |
|---|---|
| SMILES | CCOC(=O)NCCCOC(=O)NC1=CC=CC=C1 |
| InChIKey | PKUWSSYTKUFWSE-UHFFFAOYSA-N |
Product Overview
Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate (CAS 5659-61-0), with molecular formula C13H18N2O4 and molecular weight 266.13 g/mol. IUPAC: 3-(ethoxycarbonylamino)propyl N-phenylcarbamate.
Chemical Property Profile of Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate
Property Insights of Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate. Following Lipinski's Rule of Five, Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate has 2 hydrogen bond donor(s) and 4 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 Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate?
The CAS number of Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate is 5659-61-0.
What is the molecular formula of Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate?
The molecular formula of Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate is C13H18N2O4.
What is the molecular weight of Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate?
The molecular weight of Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate is 266.13 g/mol.
Where can I buy Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate?
You can request a quote for Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, (3-hydroxypropyl)-, ethyl ester, carbanilate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.