![1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one structure](/static/products/1164/1164556-97-1.webp)
1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one
TL;DR: 1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one (CAS 1164556-97-1) is a chemical compound with molecular formula C21H17ClF3N3O and molecular weight 419.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one
Also Known As: 1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one, 1-{1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-indol-3-yl}-5-(dimethylamino)-1,4-pentadien-3-one
| Molecular Formula | C21H17ClF3N3O |
|---|---|
| Molecular Weight | 419.10 g/mol |
| LogP | 5.3553 |
| Topological Polar Surface Area | 38.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 419.10123 |
| Heavy Atoms | 29 |
| Complexity | 1114.0471 |
Chemical Identifiers
| CAS Number | 1164556-97-1 |
|---|---|
| SMILES | CN(C)C=CC(=O)C=CC1=CN(C2=CC=CC=C21)C3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one (CAS 1164556-97-1), with molecular formula C21H17ClF3N3O and molecular weight 419.10 g/mol. IUPAC: 1-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one.
Chemical Property Profile of 1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one
Property Insights of 1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one
The XLogP value of 5.3553 indicates that 1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.13 Ų, 1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one?
The CAS number of 1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one is 1164556-97-1.
What is the molecular formula of 1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one?
The molecular formula of 1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one is C21H17ClF3N3O.
What is the molecular weight of 1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one?
The molecular weight of 1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one is 419.10 g/mol.
Where can I buy 1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one?
You can request a quote for 1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-5-(dimethylamino)penta-1,4-dien-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.