![tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate structure](/static/products/5795/579523-40-3.webp)
tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate
TL;DR: tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate (CAS 579523-40-3) is a chemical compound with molecular formula C21H22ClN3O3 and molecular weight 399.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate
Also Known As: ASN 05276645, tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate, Carbamic acid, [3-[(2-chlorophenyl)methyl]-3,4-dihydro-2-methyl-4-oxo-6-quinazolinyl]-, 1,1-dimethylethyl ester (9CI), Carbamicacid,[3-[ methyl]-3,4-dihydro-2-methyl-4-oxo-6-quinazolinyl]-,1,1-dimethylethylester
| Molecular Formula | C21H22ClN3O3 |
|---|---|
| Molecular Weight | 399.13 g/mol |
| LogP | 4.75362 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 399.13498 |
| Heavy Atoms | 28 |
| Complexity | 1100.2266 |
Chemical Identifiers
| CAS Number | 579523-40-3 |
|---|---|
| SMILES | CC1=NC2=C(C=C(C=C2)NC(=O)OC(C)(C)C)C(=O)N1CC3=CC=CC=C3Cl |
Product Overview
tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate (CAS 579523-40-3), with molecular formula C21H22ClN3O3 and molecular weight 399.13 g/mol. IUPAC: tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate.
Chemical Property Profile of tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate
Property Insights of tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate
The XLogP value of 4.75362 indicates that tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate. Following Lipinski's Rule of Five, tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate has 1 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 tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate?
The CAS number of tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate is 579523-40-3.
What is the molecular formula of tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate?
The molecular formula of tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate is C21H22ClN3O3.
What is the molecular weight of tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate?
The molecular weight of tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate is 399.13 g/mol.
Where can I buy tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate?
You can request a quote for tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-[3-[(2-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.