2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One
TL;DR: 2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One (CAS 27545-02-4) is a chemical compound with molecular formula C10H11ClN2O and molecular weight 210.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(chloromethyl)-2-methyl-1,3-dihydroquinazolin-4-one
Also Known As: 2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One, 2-(Chloromethyl)-2-methyl-2,3-dihydroquinazolin-4(1H)-one, 2-(chloromethyl)-2-methyl-1,3-dihydroquinazolin-4-one, 2-(chloromethyl)-2-methyl-2,3-dihydro-4(1H)-quinazolinone
| Molecular Formula | C10H11ClN2O |
|---|---|
| Molecular Weight | 210.06 g/mol |
| LogP | 1.7969 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.05598 |
| Heavy Atoms | 14 |
| Complexity | 380.13968 |
Chemical Identifiers
| CAS Number | 27545-02-4 |
|---|---|
| SMILES | CC1(NC2=CC=CC=C2C(=O)N1)CCl |
Product Overview
2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One (CAS 27545-02-4), with molecular formula C10H11ClN2O and molecular weight 210.06 g/mol. IUPAC: 2-(chloromethyl)-2-methyl-1,3-dihydroquinazolin-4-one.
Chemical Property Profile of 2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One
Property Insights of 2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One
The XLogP value of 1.7969 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One. With a topological polar surface area (TPSA) of 41.13 Ų, 2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One has 2 hydrogen bond donor(s) and 2 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 2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One?
The CAS number of 2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One is 27545-02-4.
What is the molecular formula of 2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One?
The molecular formula of 2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One is C10H11ClN2O.
What is the molecular weight of 2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One?
The molecular weight of 2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One is 210.06 g/mol.
Where can I buy 2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One?
You can request a quote for 2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One?
Yes, KEHONG BIO provides custom synthesis services for 2-(Chloromethyl)-2-Methyl-1,2,3,4-Tetrahydroquinazolin-4-One and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.