BAS 09529070
TL;DR: BAS 09529070 (CAS 712347-55-2) is a chemical compound with molecular formula C18H15BrN2O4 and molecular weight 402.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide
Also Known As: BAS 09529070, AN-329/43211395, N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide, 3-(3-bromophenyl)-N-piperonyl-2-isoxazoline-5-carboxamide, 3-(3-Bromo-phenyl)-4,5-dihydro-isoxazole-5-carboxylic acid (benzo[1,3]dioxol-5-ylmethyl)-amide
| Molecular Formula | C18H15BrN2O4 |
|---|---|
| Molecular Weight | 402.02 g/mol |
| LogP | 2.9872 |
| Topological Polar Surface Area | 69.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.0215 |
| Heavy Atoms | 25 |
| Complexity | 852.7197 |
Chemical Identifiers
| CAS Number | 712347-55-2 |
|---|---|
| SMILES | C1C(ON=C1C2=CC(=CC=C2)Br)C(=O)NCC3=CC4=C(C=C3)OCO4 |
Product Overview
BAS 09529070 (CAS 712347-55-2), with molecular formula C18H15BrN2O4 and molecular weight 402.02 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide.
Chemical Property Profile of BAS 09529070
Property Insights of BAS 09529070
The XLogP value of 2.9872 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 09529070. The TPSA of 69.15 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09529070. Following Lipinski's Rule of Five, BAS 09529070 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 BAS 09529070?
The CAS number of BAS 09529070 is 712347-55-2.
What is the molecular formula of BAS 09529070?
The molecular formula of BAS 09529070 is C18H15BrN2O4.
What is the molecular weight of BAS 09529070?
The molecular weight of BAS 09529070 is 402.02 g/mol.
Where can I buy BAS 09529070?
You can request a quote for BAS 09529070 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09529070?
Yes, KEHONG BIO provides custom synthesis services for BAS 09529070 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.