BAS 12994037
TL;DR: BAS 12994037 (CAS 878415-83-9) is a chemical compound with molecular formula C22H17N3O4 and molecular weight 387.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Also Known As: BAS 12994037, N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide, N-(4-(oxazolo[4,5-b]pyridin-2-yl)benzyl)-2,3-dihydrobenzo[b][1,4]dioxine-6-carboxamide, N-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)benzyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide, N-[(4-{[1,3]OXAZOLO[4,5-B]PYRIDIN-2-YL}PHENYL)METHYL]-2,3-DIHYDRO-1,4-BENZODIOXINE-6-CARBOXAMIDE
| Molecular Formula | C22H17N3O4 |
|---|---|
| Molecular Weight | 387.12 g/mol |
| LogP | 3.591 |
| Topological Polar Surface Area | 86.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.12192 |
| Heavy Atoms | 29 |
| Complexity | 1151.3694 |
Chemical Identifiers
| CAS Number | 878415-83-9 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)C(=O)NCC3=CC=C(C=C3)C4=NC5=C(O4)C=CC=N5 |
Product Overview
BAS 12994037 (CAS 878415-83-9), with molecular formula C22H17N3O4 and molecular weight 387.12 g/mol. IUPAC: N-[[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide.
Chemical Property Profile of BAS 12994037
Property Insights of BAS 12994037
The XLogP value of 3.591 indicates that BAS 12994037 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.48 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12994037. Following Lipinski's Rule of Five, BAS 12994037 has 1 hydrogen bond donor(s) and 6 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 12994037?
The CAS number of BAS 12994037 is 878415-83-9.
What is the molecular formula of BAS 12994037?
The molecular formula of BAS 12994037 is C22H17N3O4.
What is the molecular weight of BAS 12994037?
The molecular weight of BAS 12994037 is 387.12 g/mol.
Where can I buy BAS 12994037?
You can request a quote for BAS 12994037 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12994037?
Yes, KEHONG BIO provides custom synthesis services for BAS 12994037 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.