AB00112929-01
TL;DR: AB00112929-01 (CAS 430459-49-7) is a chemical compound with molecular formula C14H14N2O5 and molecular weight 290.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(5-methoxycarbonyl-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl)benzoic acid
Also Known As: AB00112929-01, 4-(5-methoxycarbonyl-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl)benzoic Acid, 4-(5-(methoxycarbonyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidin-4-yl)benzoic acid, 4-(5-methoxycarbonyl-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidin-4-yl)benzoic acid, 4-[5-(methoxycarbonyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidin-4-yl]benzoic acid
| Molecular Formula | C14H14N2O5 |
|---|---|
| Molecular Weight | 290.09 g/mol |
| LogP | 1.1857 |
| Topological Polar Surface Area | 104.73 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.09027 |
| Heavy Atoms | 21 |
| Complexity | 633.2694 |
Chemical Identifiers
| CAS Number | 430459-49-7 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CC=C(C=C2)C(=O)O)C(=O)OC |
Product Overview
AB00112929-01 (CAS 430459-49-7), with molecular formula C14H14N2O5 and molecular weight 290.09 g/mol. IUPAC: 4-(5-methoxycarbonyl-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl)benzoic acid.
Chemical Property Profile of AB00112929-01
Property Insights of AB00112929-01
The XLogP value of 1.1857 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00112929-01. The TPSA of 104.73 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00112929-01. Following Lipinski's Rule of Five, AB00112929-01 has 3 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 AB00112929-01?
The CAS number of AB00112929-01 is 430459-49-7.
What is the molecular formula of AB00112929-01?
The molecular formula of AB00112929-01 is C14H14N2O5.
What is the molecular weight of AB00112929-01?
The molecular weight of AB00112929-01 is 290.09 g/mol.
Where can I buy AB00112929-01?
You can request a quote for AB00112929-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00112929-01?
Yes, KEHONG BIO provides custom synthesis services for AB00112929-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.