BAS 04443171
TL;DR: BAS 04443171 (CAS 626205-18-3) is a chemical compound with molecular formula C20H22N6O3 and molecular weight 394.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-[4-(furan-2-ylmethylamino)-6-methoxy-1,3,5-triazin-2-yl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
Also Known As: BAS 04443171, 3-[4-[(2-Furanylmethyl)amino]-6-methoxy-1,3,5-triazin-2-yl]-1,2,3,4,5,6-hexahydro-1,5-methano-8H-pyrido[1,2-a][1,5]diazocin-8-one
| Molecular Formula | C20H22N6O3 |
|---|---|
| Molecular Weight | 394.18 g/mol |
| LogP | 1.8707 |
| Topological Polar Surface Area | 98.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 394.17532 |
| Heavy Atoms | 29 |
| Complexity | 1064.3285 |
Chemical Identifiers
| CAS Number | 626205-18-3 |
|---|---|
| SMILES | COC1=NC(=NC(=N1)N2CC3CC(C2)C4=CC=CC(=O)N4C3)NCC5=CC=CO5 |
Product Overview
BAS 04443171 (CAS 626205-18-3), with molecular formula C20H22N6O3 and molecular weight 394.18 g/mol. IUPAC: 11-[4-(furan-2-ylmethylamino)-6-methoxy-1,3,5-triazin-2-yl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one.
Chemical Property Profile of BAS 04443171
Property Insights of BAS 04443171
The XLogP value of 1.8707 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04443171. The TPSA of 98.31 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04443171. Following Lipinski's Rule of Five, BAS 04443171 has 1 hydrogen bond donor(s) and 8 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 04443171?
The CAS number of BAS 04443171 is 626205-18-3.
What is the molecular formula of BAS 04443171?
The molecular formula of BAS 04443171 is C20H22N6O3.
What is the molecular weight of BAS 04443171?
The molecular weight of BAS 04443171 is 394.18 g/mol.
Where can I buy BAS 04443171?
You can request a quote for BAS 04443171 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04443171?
Yes, KEHONG BIO provides custom synthesis services for BAS 04443171 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.