1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one
TL;DR: 1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one (CAS 34790-85-7) is a chemical compound with molecular formula C11H13ClN2O and molecular weight 224.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-chlorophenyl)methyl]-1,3-diazinan-2-one
Also Known As: 1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one, 1-[(4-chlorophenyl)methyl]-1,3-diazinan-2-one, 2(1H)-Pyrimidinone, 1-[(4-chlorophenyl)methyl]tetrahydro-
| Molecular Formula | C11H13ClN2O |
|---|---|
| Molecular Weight | 224.07 g/mol |
| LogP | 2.2553 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.07164 |
| Heavy Atoms | 15 |
| Complexity | 350.11047 |
Chemical Identifiers
| CAS Number | 34790-85-7 |
|---|---|
| SMILES | C1CNC(=O)N(C1)CC2=CC=C(C=C2)Cl |
Product Overview
1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one (CAS 34790-85-7), with molecular formula C11H13ClN2O and molecular weight 224.07 g/mol. IUPAC: 1-[(4-chlorophenyl)methyl]-1,3-diazinan-2-one.
Chemical Property Profile of 1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one
Property Insights of 1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one
The XLogP value of 2.2553 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one. With a topological polar surface area (TPSA) of 32.34 Ų, 1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one has 1 hydrogen bond donor(s) and 1 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 1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one?
The CAS number of 1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one is 34790-85-7.
What is the molecular formula of 1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one?
The molecular formula of 1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one is C11H13ClN2O.
What is the molecular weight of 1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one?
The molecular weight of 1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one is 224.07 g/mol.
Where can I buy 1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one?
You can request a quote for 1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-chlorobenzyl)tetrahydropyrimidin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.