N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide
TL;DR: N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide (CAS 712347-38-1) is a chemical compound with molecular formula C17H13BrN2O4 and molecular weight 388.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide
Also Known As: BAS 09528995, AN-329/43211373, N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide, 3-(3-Bromo-phenyl)-4,5-dihydro-isoxazole-5-carboxylic acid benzo[1,3]dioxol-5-ylamide, N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-5-isoxazolecarboxamide
| Molecular Formula | C17H13BrN2O4 |
|---|---|
| Molecular Weight | 388.01 g/mol |
| LogP | 3.3095 |
| Topological Polar Surface Area | 69.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 388.00586 |
| Heavy Atoms | 24 |
| Complexity | 837.0903 |
Chemical Identifiers
| CAS Number | 712347-38-1 |
|---|---|
| SMILES | C1C(ON=C1C2=CC(=CC=C2)Br)C(=O)NC3=CC4=C(C=C3)OCO4 |
Product Overview
N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide (CAS 712347-38-1), with molecular formula C17H13BrN2O4 and molecular weight 388.01 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide
Property Insights of N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide
The XLogP value of 3.3095 indicates that N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.15 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide has 1 hydrogen bond donor(s) and 5 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-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide?
The CAS number of N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide is 712347-38-1.
What is the molecular formula of N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide?
The molecular formula of N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide is C17H13BrN2O4.
What is the molecular weight of N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide?
The molecular weight of N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide is 388.01 g/mol.
Where can I buy N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide?
You can request a quote for N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.