UPCMLD0ENAT5806533:001
TL;DR: UPCMLD0ENAT5806533:001 (CAS 381695-87-0) is a chemical compound with molecular formula C29H22N4OS and molecular weight 474.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(1,3-diphenylpyrazol-4-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-thiophen-2-ylmethanone
Also Known As: UPCMLD0ENAT5806533:001, F0805-0057, [3-(1,3-diphenylpyrazol-4-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-thiophen-2-ylmethanone, 1',3',5-triphenyl-2-(thiophene-2-carbonyl)-3,4-dihydro-1'H,2H-3,4'-bipyrazole, thiophen-2-yl(1',3',5-triphenyl-3,4-dihydro-1'H,2H-[3,4'-bipyrazol]-2-yl)methanone
| Molecular Formula | C29H22N4OS |
|---|---|
| Molecular Weight | 474.15 g/mol |
| LogP | 6.5923 |
| Topological Polar Surface Area | 50.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 474.15143 |
| Heavy Atoms | 35 |
| Complexity | 1476.0159 |
Chemical Identifiers
| CAS Number | 381695-87-0 |
|---|---|
| SMILES | C1C(N(N=C1C2=CC=CC=C2)C(=O)C3=CC=CS3)C4=CN(N=C4C5=CC=CC=C5)C6=CC=CC=C6 |
Product Overview
UPCMLD0ENAT5806533:001 (CAS 381695-87-0), with molecular formula C29H22N4OS and molecular weight 474.15 g/mol. IUPAC: [3-(1,3-diphenylpyrazol-4-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-thiophen-2-ylmethanone.
Chemical Property Profile of UPCMLD0ENAT5806533:001
Property Insights of UPCMLD0ENAT5806533:001
The XLogP value of 6.5923 indicates that UPCMLD0ENAT5806533:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.49 Ų, UPCMLD0ENAT5806533:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT5806533:001 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT5806533:001?
The CAS number of UPCMLD0ENAT5806533:001 is 381695-87-0.
What is the molecular formula of UPCMLD0ENAT5806533:001?
The molecular formula of UPCMLD0ENAT5806533:001 is C29H22N4OS.
What is the molecular weight of UPCMLD0ENAT5806533:001?
The molecular weight of UPCMLD0ENAT5806533:001 is 474.15 g/mol.
Where can I buy UPCMLD0ENAT5806533:001?
You can request a quote for UPCMLD0ENAT5806533:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5806533:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5806533:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.