BAS 00722147
TL;DR: BAS 00722147 (CAS 488859-07-0) is a chemical compound with molecular formula C16H16N2O2 and molecular weight 268.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(anilinomethyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
Also Known As: BAS 00722147, BIM-0037070.P001, AB00100685-01, 2-[(phenylamino)methyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione, 4-(anilinomethyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
| Molecular Formula | C16H16N2O2 |
|---|---|
| Molecular Weight | 268.12 g/mol |
| LogP | 1.8631 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.1212 |
| Heavy Atoms | 20 |
| Complexity | 565.7543 |
Chemical Identifiers
| CAS Number | 488859-07-0 |
|---|---|
| SMILES | C1C2C=CC1C3C2C(=O)N(C3=O)CNC4=CC=CC=C4 |
Product Overview
BAS 00722147 (CAS 488859-07-0), with molecular formula C16H16N2O2 and molecular weight 268.12 g/mol. IUPAC: 4-(anilinomethyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione.
Chemical Property Profile of BAS 00722147
Property Insights of BAS 00722147
The XLogP value of 1.8631 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00722147. With a topological polar surface area (TPSA) of 49.41 Ų, BAS 00722147 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00722147 has 1 hydrogen bond donor(s) and 3 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 00722147?
The CAS number of BAS 00722147 is 488859-07-0.
What is the molecular formula of BAS 00722147?
The molecular formula of BAS 00722147 is C16H16N2O2.
What is the molecular weight of BAS 00722147?
The molecular weight of BAS 00722147 is 268.12 g/mol.
Where can I buy BAS 00722147?
You can request a quote for BAS 00722147 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00722147?
Yes, KEHONG BIO provides custom synthesis services for BAS 00722147 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.