2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl-
TL;DR: 2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl- (CAS 71472-54-3) is a chemical compound with molecular formula C16H15NO2 and molecular weight 253.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-phenylmethanone
Also Known As: 2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl-, (6-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-phenylmethanone, (6-Methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)(phenyl)methanone, (3-methyl-7-oxa-10-azabicyclo[4.4.0]deca-2,4,11-trien-10-yl)-phenyl-methanone
| Molecular Formula | C16H15NO2 |
|---|---|
| Molecular Weight | 253.11 g/mol |
| LogP | 3.03422 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 253.11028 |
| Heavy Atoms | 19 |
| Complexity | 607.40094 |
Chemical Identifiers
| CAS Number | 71472-54-3 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)OCCN2C(=O)C3=CC=CC=C3 |
Product Overview
2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl- (CAS 71472-54-3), with molecular formula C16H15NO2 and molecular weight 253.11 g/mol. IUPAC: (6-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-phenylmethanone.
Chemical Property Profile of 2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl-
Property Insights of 2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl-
The XLogP value of 3.03422 indicates that 2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, 2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl- has 0 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 2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl-?
The CAS number of 2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl- is 71472-54-3.
What is the molecular formula of 2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl-?
The molecular formula of 2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl- is C16H15NO2.
What is the molecular weight of 2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl-?
The molecular weight of 2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl- is 253.11 g/mol.
Where can I buy 2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl-?
You can request a quote for 2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,4-Benzoxazine, 4-benzoyl-3,4-dihydro-6-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.