N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
TL;DR: N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide (CAS 712271-19-7) is a chemical compound with molecular formula C16H15NO3 and molecular weight 269.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Also Known As: Maybridge3_002798, N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide, IDI1_014185, VU0508867-1, 2H,3H,4H-benzo[b]1,4-dioxepin-7-yl-N-benzamide
| Molecular Formula | C16H15NO3 |
|---|---|
| Molecular Weight | 269.11 g/mol |
| LogP | 3.1002 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 269.1052 |
| Heavy Atoms | 20 |
| Complexity | 610.37396 |
Chemical Identifiers
| CAS Number | 712271-19-7 |
|---|---|
| SMILES | C1COC2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3)OC1 |
Product Overview
N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide (CAS 712271-19-7), with molecular formula C16H15NO3 and molecular weight 269.11 g/mol. IUPAC: N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide.
Chemical Property Profile of N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Property Insights of N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
The XLogP value of 3.1002 indicates that N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide 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-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide?
The CAS number of N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide is 712271-19-7.
What is the molecular formula of N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide?
The molecular formula of N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide is C16H15NO3.
What is the molecular weight of N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide?
The molecular weight of N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide is 269.11 g/mol.
Where can I buy N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide?
You can request a quote for N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-phenyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.