UPCMLD0ENAT5669810:001
TL;DR: UPCMLD0ENAT5669810:001 (CAS 361480-33-3) is a chemical compound with molecular formula C18H12Br2N2O2S and molecular weight 477.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-bromofuran-2-yl)-[3-(4-bromophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]methanone
Also Known As: UPCMLD0ENAT5669810:001, F0805-0130, 1-(5-bromofuran-2-carbonyl)-5-(4-bromophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazole, (5-bromofuran-2-yl)-[3-(4-bromophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]methanone, 5-bromo(2-furyl) 5-(4-bromophenyl)-3-(2-thienyl)(2-pyrazolinyl) ketone
| Molecular Formula | C18H12Br2N2O2S |
|---|---|
| Molecular Weight | 477.90 g/mol |
| LogP | 5.8576 |
| Topological Polar Surface Area | 45.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 477.89862 |
| Heavy Atoms | 25 |
| Complexity | 932.409 |
Chemical Identifiers
| CAS Number | 361480-33-3 |
|---|---|
| SMILES | C1C(N(N=C1C2=CC=CS2)C(=O)C3=CC=C(O3)Br)C4=CC=C(C=C4)Br |
Product Overview
UPCMLD0ENAT5669810:001 (CAS 361480-33-3), with molecular formula C18H12Br2N2O2S and molecular weight 477.90 g/mol. IUPAC: (5-bromofuran-2-yl)-[3-(4-bromophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]methanone.
Chemical Property Profile of UPCMLD0ENAT5669810:001
Property Insights of UPCMLD0ENAT5669810:001
The XLogP value of 5.8576 indicates that UPCMLD0ENAT5669810:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.81 Ų, UPCMLD0ENAT5669810:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT5669810:001 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 UPCMLD0ENAT5669810:001?
The CAS number of UPCMLD0ENAT5669810:001 is 361480-33-3.
What is the molecular formula of UPCMLD0ENAT5669810:001?
The molecular formula of UPCMLD0ENAT5669810:001 is C18H12Br2N2O2S.
What is the molecular weight of UPCMLD0ENAT5669810:001?
The molecular weight of UPCMLD0ENAT5669810:001 is 477.90 g/mol.
Where can I buy UPCMLD0ENAT5669810:001?
You can request a quote for UPCMLD0ENAT5669810:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5669810:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5669810:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.