N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide
TL;DR: N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide (CAS 13885-82-0) is a chemical compound with molecular formula C17H18N2O2 and molecular weight 282.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-benzyl-2,4-dihydro-1,3-benzoxazin-6-yl)acetamide
Also Known As: ChemDiv2_004987, IDI1_003702, N-(3-benzyl-2,4-dihydro-1,3-benzoxazin-6-yl)acetamide, N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide, N-(3-benzyl-3,4-dihydro-2H-benzo[e][1,3]oxazin-6-yl)acetamide
| Molecular Formula | C17H18N2O2 |
|---|---|
| Molecular Weight | 282.14 g/mol |
| LogP | 2.9971 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.13684 |
| Heavy Atoms | 21 |
| Complexity | 640.4933 |
Chemical Identifiers
| CAS Number | 13885-82-0 |
|---|---|
| SMILES | CC(=O)NC1=CC2=C(C=C1)OCN(C2)CC3=CC=CC=C3 |
Product Overview
N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide (CAS 13885-82-0), with molecular formula C17H18N2O2 and molecular weight 282.14 g/mol. IUPAC: N-(3-benzyl-2,4-dihydro-1,3-benzoxazin-6-yl)acetamide.
Chemical Property Profile of N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide
Property Insights of N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide
The XLogP value of 2.9971 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide. With a topological polar surface area (TPSA) of 41.57 Ų, N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide has 1 hydrogen bond donor(s) and 3 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 N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide?
The CAS number of N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide is 13885-82-0.
What is the molecular formula of N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide?
The molecular formula of N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide is C17H18N2O2.
What is the molecular weight of N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide?
The molecular weight of N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide is 282.14 g/mol.
Where can I buy N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide?
You can request a quote for N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-benzyl-3,4-dihydro-2H-1,3-benzoxazin-6-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.