BIM-0026114.P001
TL;DR: BIM-0026114.P001 (CAS 339334-80-4) is a chemical compound with molecular formula C16H11ClF3NO4 and molecular weight 373.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-chloro-5-(trifluoromethyl)phenyl]-7-(hydroxymethyl)-4,7a-dihydro-3aH-4,7-epoxyisoindole-1,3-dione
Also Known As: BIM-0026114.P001, AB00090635-01, A1549/0067414, 2-[2-chloro-5-(trifluoromethyl)phenyl]-4-(hydroxymethyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione, 2-[2-chloro-5-(trifluoromethyl)phenyl]-7-(hydroxymethyl)-4,7a-dihydro-3aH-4,7-epoxyisoindole-1,3-dione
| Molecular Formula | C16H11ClF3NO4 |
|---|---|
| Molecular Weight | 373.03 g/mol |
| LogP | 2.1641 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 373.03287 |
| Heavy Atoms | 25 |
| Complexity | 824.08813 |
Chemical Identifiers
| CAS Number | 339334-80-4 |
|---|---|
| SMILES | C1=CC2(C3C(C1O2)C(=O)N(C3=O)C4=C(C=CC(=C4)C(F)(F)F)Cl)CO |
Product Overview
BIM-0026114.P001 (CAS 339334-80-4), with molecular formula C16H11ClF3NO4 and molecular weight 373.03 g/mol. IUPAC: 2-[2-chloro-5-(trifluoromethyl)phenyl]-7-(hydroxymethyl)-4,7a-dihydro-3aH-4,7-epoxyisoindole-1,3-dione.
Chemical Property Profile of BIM-0026114.P001
Property Insights of BIM-0026114.P001
The XLogP value of 2.1641 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0026114.P001. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0026114.P001. Following Lipinski's Rule of Five, BIM-0026114.P001 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 BIM-0026114.P001?
The CAS number of BIM-0026114.P001 is 339334-80-4.
What is the molecular formula of BIM-0026114.P001?
The molecular formula of BIM-0026114.P001 is C16H11ClF3NO4.
What is the molecular weight of BIM-0026114.P001?
The molecular weight of BIM-0026114.P001 is 373.03 g/mol.
Where can I buy BIM-0026114.P001?
You can request a quote for BIM-0026114.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0026114.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0026114.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.