4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)-
TL;DR: 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)- (CAS 114439-74-6) is a chemical compound with molecular formula C22H16ClNO3 and molecular weight 377.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorobenzoyl)-2-(4-methylphenyl)-2H-1,3-benzoxazin-4-one
Also Known As: 2-(4-Tolyl)-3-(4-chlorobenzoyl)-4-oxo-4H-2,3-dihydro-1,3-benzoxazine, 2,3-Dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)-4H-1,3-benzoxazin-4-one, 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)-, 3-(4-chlorobenzoyl)-2-(4-methylphenyl)-2H-1,3-benzoxazin-4-one, 3-(4-Chlorobenzoyl)-2-(4-methylphenyl)-2,3-dihydro-4H-1,3-benzoxazin-4-one
| Molecular Formula | C22H16ClNO3 |
|---|---|
| Molecular Weight | 377.08 g/mol |
| LogP | 5.02222 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 377.08188 |
| Heavy Atoms | 27 |
| Complexity | 1012.4877 |
Chemical Identifiers
| CAS Number | 114439-74-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2N(C(=O)C3=CC=CC=C3O2)C(=O)C4=CC=C(C=C4)Cl |
Product Overview
4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)- (CAS 114439-74-6), with molecular formula C22H16ClNO3 and molecular weight 377.08 g/mol. IUPAC: 3-(4-chlorobenzoyl)-2-(4-methylphenyl)-2H-1,3-benzoxazin-4-one.
Chemical Property Profile of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)-
Property Insights of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)-
The XLogP value of 5.02222 indicates that 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)-?
The CAS number of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)- is 114439-74-6.
What is the molecular formula of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)-?
The molecular formula of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)- is C22H16ClNO3.
What is the molecular weight of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)-?
The molecular weight of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)- is 377.08 g/mol.
Where can I buy 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)-?
You can request a quote for 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-(4-chlorobenzoyl)-2-(4-methylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.