3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid
TL;DR: 3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid (CAS 216774-33-3) is a chemical compound with molecular formula C14H16N2O4 and molecular weight 276.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-(4-morpholin-4-ylanilino)-4-oxobut-2-enoic acid
Also Known As: BAS 00781411, IDI1_008562, 3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid, 4-(4-morpholinoanilino)-4-oxobut-2-enoic acid, AB00080793-01
| Molecular Formula | C14H16N2O4 |
|---|---|
| Molecular Weight | 276.11 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.111 |
| Heavy Atoms | 20 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 216774-33-3 |
|---|---|
| SMILES | C1COCCN1C2=CC=C(C=C2)NC(=O)/C=C/C(=O)O |
| InChIKey | XYVYQZXVYXSMNY-AATRIKPKSA-N |
Product Overview
3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid (CAS 216774-33-3), with molecular formula C14H16N2O4 and molecular weight 276.11 g/mol. IUPAC: (E)-4-(4-morpholin-4-ylanilino)-4-oxobut-2-enoic acid.
Chemical Property Profile of 3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid
Property Insights of 3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid. Following Lipinski's Rule of Five, 3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid has 2 hydrogen bond donor(s) and 5 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-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid?
The CAS number of 3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid is 216774-33-3.
What is the molecular formula of 3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid?
The molecular formula of 3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid is C14H16N2O4.
What is the molecular weight of 3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid?
The molecular weight of 3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid is 276.11 g/mol.
Where can I buy 3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid?
You can request a quote for 3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Morpholin-4-yl-phenylcarbamoyl)-acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.