2H-016
TL;DR: 2H-016 (CAS 338397-52-7) is a chemical compound with molecular formula C17H10Cl2F3N3O and molecular weight 399.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]pyrrole-2-carboxamide
Also Known As: 2H-016, N-(4-chlorophenyl)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-pyrrole-2-carboxamide, N-(4-chlorophenyl)-1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]pyrrole-2-carboxamide, 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-(4-chlorophenyl)-1H-pyrrole-2-carboxamide
| Molecular Formula | C17H10Cl2F3N3O |
|---|---|
| Molecular Weight | 399.02 g/mol |
| LogP | 5.4502 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 399.0153 |
| Heavy Atoms | 26 |
| Complexity | 952.6321 |
Chemical Identifiers
| CAS Number | 338397-52-7 |
|---|---|
| SMILES | C1=CN(C(=C1)C(=O)NC2=CC=C(C=C2)Cl)C3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
2H-016 (CAS 338397-52-7), with molecular formula C17H10Cl2F3N3O and molecular weight 399.02 g/mol. IUPAC: N-(4-chlorophenyl)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]pyrrole-2-carboxamide.
Chemical Property Profile of 2H-016
Property Insights of 2H-016
The XLogP value of 5.4502 indicates that 2H-016 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.92 Ų, 2H-016 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-016 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2H-016?
The CAS number of 2H-016 is 338397-52-7.
What is the molecular formula of 2H-016?
The molecular formula of 2H-016 is C17H10Cl2F3N3O.
What is the molecular weight of 2H-016?
The molecular weight of 2H-016 is 399.02 g/mol.
Where can I buy 2H-016?
You can request a quote for 2H-016 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-016?
Yes, KEHONG BIO provides custom synthesis services for 2H-016 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.