4W-0307
TL;DR: 4W-0307 (CAS 866018-76-0) is a chemical compound with molecular formula C27H21ClF3N3O and molecular weight 495.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-chlorophenyl)methyl]-4-[3-[3-(trifluoromethyl)phenyl]-5,6-dihydro-4H-cyclopenta[c]pyrazol-2-yl]benzamide
Also Known As: 4W-0307, N-(4-chlorobenzyl)-4-[3-[3-(trifluoromethyl)phenyl]-5,6-dihydrocyclopenta[c]pyrazol-2(4H)-yl]benzenecarboxamide, N-[(4-chlorophenyl)methyl]-4-[3-[3-(trifluoromethyl)phenyl]-5,6-dihydro-4H-cyclopenta[c]pyrazol-2-yl]benzamide, N-[(4-chlorophenyl)methyl]-4-{3-[3-(trifluoromethyl)phenyl]-2H,4H,5H,6H-cyclopenta[c]pyrazol-2-yl}benzamide, N-[(4-chlorophenyl)methyl]-4-{3-[3-(trifluoromethyl)phenyl]-4H,5H,6H-cyclopenta[c]pyrazol-2-yl}benzamide
| Molecular Formula | C27H21ClF3N3O |
|---|---|
| Molecular Weight | 495.13 g/mol |
| LogP | 6.6302 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 495.13254 |
| Heavy Atoms | 35 |
| Complexity | 1376.5496 |
Chemical Identifiers
| CAS Number | 866018-76-0 |
|---|---|
| SMILES | C1CC2=C(N(N=C2C1)C3=CC=C(C=C3)C(=O)NCC4=CC=C(C=C4)Cl)C5=CC(=CC=C5)C(F)(F)F |
Product Overview
4W-0307 (CAS 866018-76-0), with molecular formula C27H21ClF3N3O and molecular weight 495.13 g/mol. IUPAC: N-[(4-chlorophenyl)methyl]-4-[3-[3-(trifluoromethyl)phenyl]-5,6-dihydro-4H-cyclopenta[c]pyrazol-2-yl]benzamide.
Chemical Property Profile of 4W-0307
Property Insights of 4W-0307
The XLogP value of 6.6302 indicates that 4W-0307 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.92 Ų, 4W-0307 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4W-0307 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 4W-0307?
The CAS number of 4W-0307 is 866018-76-0.
What is the molecular formula of 4W-0307?
The molecular formula of 4W-0307 is C27H21ClF3N3O.
What is the molecular weight of 4W-0307?
The molecular weight of 4W-0307 is 495.13 g/mol.
Where can I buy 4W-0307?
You can request a quote for 4W-0307 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4W-0307?
Yes, KEHONG BIO provides custom synthesis services for 4W-0307 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.