Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester
TL;DR: Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester (CAS 86532-89-0) is a chemical compound with molecular formula C11H9N3O4 and molecular weight 247.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl N-(2,4-dioxo-1H-pyrimidin-5-yl)carbamate
Also Known As: NCIStruc1_000556, NCIStruc2_000479, NCI60_041712, phenyl 2,4-dihydroxy-5-pyrimidinylcarbamate, phenyl N-(2,4-dioxo-1H-pyrimidin-5-yl)carbamate
| Molecular Formula | C11H9N3O4 |
|---|---|
| Molecular Weight | 247.06 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 96.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.05931 |
| Heavy Atoms | 18 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 86532-89-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC(=O)NC2=CNC(=O)NC2=O |
| InChIKey | GWLJOJIFRCVMGV-UHFFFAOYSA-N |
Product Overview
Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester (CAS 86532-89-0), with molecular formula C11H9N3O4 and molecular weight 247.06 g/mol. IUPAC: phenyl N-(2,4-dioxo-1H-pyrimidin-5-yl)carbamate.
Chemical Property Profile of Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester
Property Insights of Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester. The TPSA of 96.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester. Following Lipinski's Rule of Five, Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester 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 Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester?
The CAS number of Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester is 86532-89-0.
What is the molecular formula of Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester?
The molecular formula of Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester is C11H9N3O4.
What is the molecular weight of Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester?
The molecular weight of Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester is 247.06 g/mol.
Where can I buy Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester?
You can request a quote for Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, (1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.