UPCMLD0ENAT5609755:001
TL;DR: UPCMLD0ENAT5609755:001 (CAS 442650-00-2) is a chemical compound with molecular formula C27H20ClN3O3 and molecular weight 469.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-8-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-phenylmethanone
Also Known As: UPCMLD0ENAT5609755:001, 1-benzoyl-5-{7-chloro-2H,3H-[1,4]dioxino[2,3-g]quinolin-8-yl}-3-phenyl-4,5-dihydro-1H-pyrazole, F1138-0013, [3-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-8-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-phenylmethanone, (5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-8-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl)(phenyl)methanone
| Molecular Formula | C27H20ClN3O3 |
|---|---|
| Molecular Weight | 469.12 g/mol |
| LogP | 5.6509 |
| Topological Polar Surface Area | 64.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 469.11932 |
| Heavy Atoms | 34 |
| Complexity | 1423.7721 |
Chemical Identifiers
| CAS Number | 442650-00-2 |
|---|---|
| SMILES | C1COC2=CC3=NC(=C(C=C3C=C2O1)C4CC(=NN4C(=O)C5=CC=CC=C5)C6=CC=CC=C6)Cl |
Product Overview
UPCMLD0ENAT5609755:001 (CAS 442650-00-2), with molecular formula C27H20ClN3O3 and molecular weight 469.12 g/mol. IUPAC: [3-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-8-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-phenylmethanone.
Chemical Property Profile of UPCMLD0ENAT5609755:001
Property Insights of UPCMLD0ENAT5609755:001
The XLogP value of 5.6509 indicates that UPCMLD0ENAT5609755:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.02 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5609755:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5609755:001 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT5609755:001?
The CAS number of UPCMLD0ENAT5609755:001 is 442650-00-2.
What is the molecular formula of UPCMLD0ENAT5609755:001?
The molecular formula of UPCMLD0ENAT5609755:001 is C27H20ClN3O3.
What is the molecular weight of UPCMLD0ENAT5609755:001?
The molecular weight of UPCMLD0ENAT5609755:001 is 469.12 g/mol.
Where can I buy UPCMLD0ENAT5609755:001?
You can request a quote for UPCMLD0ENAT5609755:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5609755:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5609755:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.