BAS 01107886
TL;DR: BAS 01107886 (CAS 302901-61-7) is a chemical compound with molecular formula C18H17FN2O2 and molecular weight 312.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(2-fluorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile
Also Known As: BAS 01107886, J3.775.318A, 2-amino-4-(2-fluorophenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile, AB00074097-01, 2-amino-4-(2-fluorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile
| Molecular Formula | C18H17FN2O2 |
|---|---|
| Molecular Weight | 312.13 g/mol |
| LogP | 3.27658 |
| Topological Polar Surface Area | 76.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 312.1274 |
| Heavy Atoms | 23 |
| Complexity | 799.48474 |
Chemical Identifiers
| CAS Number | 302901-61-7 |
|---|---|
| SMILES | CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC=CC=C3F)C(=O)C1)C |
Product Overview
BAS 01107886 (CAS 302901-61-7), with molecular formula C18H17FN2O2 and molecular weight 312.13 g/mol. IUPAC: 2-amino-4-(2-fluorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile.
Chemical Property Profile of BAS 01107886
Property Insights of BAS 01107886
The XLogP value of 3.27658 indicates that BAS 01107886 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.11 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01107886. Following Lipinski's Rule of Five, BAS 01107886 has 1 hydrogen bond donor(s) and 4 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 01107886?
The CAS number of BAS 01107886 is 302901-61-7.
What is the molecular formula of BAS 01107886?
The molecular formula of BAS 01107886 is C18H17FN2O2.
What is the molecular weight of BAS 01107886?
The molecular weight of BAS 01107886 is 312.13 g/mol.
Where can I buy BAS 01107886?
You can request a quote for BAS 01107886 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01107886?
Yes, KEHONG BIO provides custom synthesis services for BAS 01107886 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.