Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester
TL;DR: Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester (CAS 78533-65-0) is a chemical compound with molecular formula C14H19N3O2 and molecular weight 261.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl N-(5-phenyl-1,4,5,6-tetrahydropyrimidin-2-yl)carbamate
Also Known As: Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester, 1-Methylethyl (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)carbamate, Propan-2-yl (5-phenyl-1,4,5,6-tetrahydropyrimidin-2-yl)carbamate, propan-2-yl N-(5-phenyl-1,4,5,6-tetrahydropyrimidin-2-yl)carbamate, BRN 5574243
| Molecular Formula | C14H19N3O2 |
|---|---|
| Molecular Weight | 261.15 g/mol |
| LogP | 1.864 |
| Topological Polar Surface Area | 62.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.14774 |
| Heavy Atoms | 19 |
| Complexity | 457.0187 |
Chemical Identifiers
| CAS Number | 78533-65-0 |
|---|---|
| SMILES | CC(C)OC(=O)NC1=NCC(CN1)C2=CC=CC=C2 |
Product Overview
Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester (CAS 78533-65-0), with molecular formula C14H19N3O2 and molecular weight 261.15 g/mol. IUPAC: propan-2-yl N-(5-phenyl-1,4,5,6-tetrahydropyrimidin-2-yl)carbamate.
Chemical Property Profile of Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester
Property Insights of Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester
The XLogP value of 1.864 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester. The TPSA of 62.72 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester. Following Lipinski's Rule of Five, Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester 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 Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester?
The CAS number of Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester is 78533-65-0.
What is the molecular formula of Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester?
The molecular formula of Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester is C14H19N3O2.
What is the molecular weight of Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester?
The molecular weight of Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester is 261.15 g/mol.
Where can I buy Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester?
You can request a quote for Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl 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, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, (1,4,5,6-tetrahydro-5-phenyl-2-pyrimidinyl)-, 1-methylethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.