![3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid structure](/static/products/918/91840-16-3.png)
3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid
TL;DR: 3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid (CAS 91840-16-3) is a chemical compound with molecular formula C26H32N2O5 and molecular weight 452.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[2-(4-ethoxycarbonyl-4-phenylpiperidin-1-yl)ethyl]anilino]-4-oxobutanoic acid
Also Known As: 3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid, 4-[(4-{2-[4-(ethoxycarbonyl)-4-phenylpiperidin-1-yl]ethyl}phenyl)amino]-4-oxobutanoic acid, 4-[4-[2-(4-ethoxycarbonyl-4-phenylpiperidin-1-yl)ethyl]anilino]-4-oxobutanoic acid, 4-(4-{2-[4-(Ethoxycarbonyl)-4-phenylpiperidin-1-yl]ethyl}anilino)-4-oxobutanoic acid, 4-Piperidinecarboxylicacid, 1-[2-[4-[(3-carboxy-1-oxopropyl)amino]phenyl]ethyl]-4-phenyl-, 4-ethylester
| Molecular Formula | C26H32N2O5 |
|---|---|
| Molecular Weight | 452.23 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 95.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 452.2311 |
| Heavy Atoms | 33 |
| Complexity | 645.0 |
Chemical Identifiers
| CAS Number | 91840-16-3 |
|---|---|
| SMILES | CCOC(=O)C1(CCN(CC1)CCC2=CC=C(C=C2)NC(=O)CCC(=O)O)C3=CC=CC=C3 |
| InChIKey | IECLKPPZCDIHQN-UHFFFAOYSA-N |
Product Overview
3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid (CAS 91840-16-3), with molecular formula C26H32N2O5 and molecular weight 452.23 g/mol. IUPAC: 4-[4-[2-(4-ethoxycarbonyl-4-phenylpiperidin-1-yl)ethyl]anilino]-4-oxobutanoic acid.
Chemical Property Profile of 3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid
Property Insights of 3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid. The TPSA of 95.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid. Following Lipinski's Rule of Five, 3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid has 2 hydrogen bond donor(s) and 6 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-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid?
The CAS number of 3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid is 91840-16-3.
What is the molecular formula of 3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid?
The molecular formula of 3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid is C26H32N2O5.
What is the molecular weight of 3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid?
The molecular weight of 3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid is 452.23 g/mol.
Where can I buy 3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid?
You can request a quote for 3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid?
Yes, KEHONG BIO provides custom synthesis services for 3-[[4-[2- ethyl]phenyl]carbamoyl]propanoicacid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.