BAS 12945221
TL;DR: BAS 12945221 (CAS 831188-65-9) is a chemical compound with molecular formula C18H16N2O5 and molecular weight 340.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide
Also Known As: BAS 12945221, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-oxo-1,3-benzoxazol-3(2H)-yl)propanamide, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide, N-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-3-(2-oxo-benzooxazol-3-yl)-propionamide, N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-3-(2-oxobenzo[d]oxazol-3(2H)-yl)propanamide
| Molecular Formula | C18H16N2O5 |
|---|---|
| Molecular Weight | 340.11 g/mol |
| LogP | 2.3945 |
| Topological Polar Surface Area | 82.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 340.10593 |
| Heavy Atoms | 25 |
| Complexity | 988.5403 |
Chemical Identifiers
| CAS Number | 831188-65-9 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)NC(=O)CCN3C4=CC=CC=C4OC3=O |
Product Overview
BAS 12945221 (CAS 831188-65-9), with molecular formula C18H16N2O5 and molecular weight 340.11 g/mol. IUPAC: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide.
Chemical Property Profile of BAS 12945221
Property Insights of BAS 12945221
The XLogP value of 2.3945 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12945221. The TPSA of 82.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12945221. Following Lipinski's Rule of Five, BAS 12945221 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 12945221?
The CAS number of BAS 12945221 is 831188-65-9.
What is the molecular formula of BAS 12945221?
The molecular formula of BAS 12945221 is C18H16N2O5.
What is the molecular weight of BAS 12945221?
The molecular weight of BAS 12945221 is 340.11 g/mol.
Where can I buy BAS 12945221?
You can request a quote for BAS 12945221 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12945221?
Yes, KEHONG BIO provides custom synthesis services for BAS 12945221 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.