Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)-
TL;DR: Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)- (CAS 4046-47-3) is a chemical compound with molecular formula C14H21N3O3 and molecular weight 279.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(dimethylamino)-N-[(4-ethoxyphenyl)carbamoyl]propanamide
Also Known As: 1-(N,N-Dimethylalanyl)-3-(p-ethoxyphenyl)urea, Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)-, 3-[(2S)-2-(dimethylamino)propanoyl]-1-(4-ethoxyphenyl)urea, (2S)-2-(dimethylamino)-N-[(4-ethoxyphenyl)carbamoyl]propanamide, N-[(4-Ethoxyphenyl)carbamoyl]-N~2~,N~2~-dimethyl-L-alaninamide
| Molecular Formula | C14H21N3O3 |
|---|---|
| Molecular Weight | 279.16 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 70.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 279.1583 |
| Heavy Atoms | 20 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 4046-47-3 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)NC(=O)[C@H](C)N(C)C |
| InChIKey | JQHJJVWPQBINOR-JTQLQIEISA-N |
Product Overview
Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)- (CAS 4046-47-3), with molecular formula C14H21N3O3 and molecular weight 279.16 g/mol. IUPAC: (2S)-2-(dimethylamino)-N-[(4-ethoxyphenyl)carbamoyl]propanamide.
Chemical Property Profile of Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)-
Property Insights of Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)-. The TPSA of 70.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)-. Following Lipinski's Rule of Five, Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)- 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 Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)-?
The CAS number of Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)- is 4046-47-3.
What is the molecular formula of Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)-?
The molecular formula of Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)- is C14H21N3O3.
What is the molecular weight of Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)-?
The molecular weight of Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)- is 279.16 g/mol.
Where can I buy Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)-?
You can request a quote for Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-(N,N-dimethylalanyl)-3-(p-ethoxyphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.