BHAP indolyl pyridyl deriv.
TL;DR: BHAP indolyl pyridyl deriv. (CAS 136816-92-7) is a chemical compound with molecular formula C20H20F3N5O and molecular weight 403.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-indol-2-yl-[4-[3-(2,2,2-trifluoroethylamino)-2-pyridinyl]piperazin-1-yl]methanone
Also Known As: BHAP indolyl pyridyl deriv., Piperazine, 1-(1H-indol-2-ylcarbonyl)-4-(3-((2,2,2-trifluoroethyl)amino)-2-pyridinyl)-, 1-(Indolyl-2-carbonyl)-4-(3-((2,2,2-trifluoroethyl)amino)-2-pyridyl)piperazine, (1H-Indol-2-yl)(4-{3-[(2,2,2-trifluoroethyl)amino]pyridin-2-yl}piperazin-1-yl)methanone, 1-(Indolyl-2-carbonyl)-4-[3-[(2,2,2-trifluoroethyl)amino]-2-pyridyl]piperazine
| Molecular Formula | C20H20F3N5O |
|---|---|
| Molecular Weight | 403.16 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 64.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.162 |
| Heavy Atoms | 29 |
| Complexity | 567.0 |
Chemical Identifiers
| CAS Number | 136816-92-7 |
|---|---|
| SMILES | C1CN(CCN1C2=C(C=CC=N2)NCC(F)(F)F)C(=O)C3=CC4=CC=CC=C4N3 |
| InChIKey | XIRPNYJLBQYQPM-UHFFFAOYSA-N |
Product Overview
BHAP indolyl pyridyl deriv. (CAS 136816-92-7), with molecular formula C20H20F3N5O and molecular weight 403.16 g/mol. IUPAC: 1H-indol-2-yl-[4-[3-(2,2,2-trifluoroethylamino)-2-pyridinyl]piperazin-1-yl]methanone.
Chemical Property Profile of BHAP indolyl pyridyl deriv.
Property Insights of BHAP indolyl pyridyl deriv.
The XLogP value of 3.8 indicates that BHAP indolyl pyridyl deriv. is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BHAP indolyl pyridyl deriv.. Following Lipinski's Rule of Five, BHAP indolyl pyridyl deriv. has 2 hydrogen bond donor(s) and 7 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 BHAP indolyl pyridyl deriv.?
The CAS number of BHAP indolyl pyridyl deriv. is 136816-92-7.
What is the molecular formula of BHAP indolyl pyridyl deriv.?
The molecular formula of BHAP indolyl pyridyl deriv. is C20H20F3N5O.
What is the molecular weight of BHAP indolyl pyridyl deriv.?
The molecular weight of BHAP indolyl pyridyl deriv. is 403.16 g/mol.
Where can I buy BHAP indolyl pyridyl deriv.?
You can request a quote for BHAP indolyl pyridyl deriv. directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BHAP indolyl pyridyl deriv.?
Yes, KEHONG BIO provides custom synthesis services for BHAP indolyl pyridyl deriv. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.