Silane,diisothiocyanato
TL;DR: Silane,diisothiocyanato (CAS 446276-01-3) is a chemical compound with molecular formula C16H12ClF3N4 and molecular weight 352.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-chloro-2-pyridinyl)-3-methyl-4-[3-(trifluoromethyl)phenyl]pyrazol-5-amine
Also Known As: Silane,diisothiocyanato, 1-(6-Chloro-2-pyridinyl)-3-methyl-4-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-amine, 3801AE, 1-(6-Chloropyridin-2-yl)-3-methyl-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine, 1-(6-Chloropyridin-2-yl)-3-methyl-4-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-amine
| Molecular Formula | C16H12ClF3N4 |
|---|---|
| Molecular Weight | 352.07 g/mol |
| LogP | 4.49712 |
| Topological Polar Surface Area | 56.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 352.07025 |
| Heavy Atoms | 24 |
| Complexity | 902.5784 |
Chemical Identifiers
| CAS Number | 446276-01-3 |
|---|---|
| SMILES | CC1=NN(C(=C1C2=CC(=CC=C2)C(F)(F)F)N)C3=NC(=CC=C3)Cl |
Product Overview
Silane,diisothiocyanato (CAS 446276-01-3), with molecular formula C16H12ClF3N4 and molecular weight 352.07 g/mol. IUPAC: 1-(6-chloro-2-pyridinyl)-3-methyl-4-[3-(trifluoromethyl)phenyl]pyrazol-5-amine.
Chemical Property Profile of Silane,diisothiocyanato
Property Insights of Silane,diisothiocyanato
The XLogP value of 4.49712 indicates that Silane,diisothiocyanato is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.73 Ų, Silane,diisothiocyanato exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Silane,diisothiocyanato 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 Silane,diisothiocyanato?
The CAS number of Silane,diisothiocyanato is 446276-01-3.
What is the molecular formula of Silane,diisothiocyanato?
The molecular formula of Silane,diisothiocyanato is C16H12ClF3N4.
What is the molecular weight of Silane,diisothiocyanato?
The molecular weight of Silane,diisothiocyanato is 352.07 g/mol.
Where can I buy Silane,diisothiocyanato?
You can request a quote for Silane,diisothiocyanato directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Silane,diisothiocyanato?
Yes, KEHONG BIO provides custom synthesis services for Silane,diisothiocyanato and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.