UPCMLD0ENAT5434306:001
TL;DR: UPCMLD0ENAT5434306:001 (CAS 863614-82-8) is a chemical compound with molecular formula C22H20FN5O2 and molecular weight 405.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[4-(2-fluorophenyl)piperazine-1-carbonyl]-6-methyl-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaen-2-one
Also Known As: UPCMLD0ENAT5434306:001, F0697-0041, 2-(4-(2-fluorophenyl)piperazine-1-carbonyl)-1-methylpyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one, 2-{[4-(2-fluorophenyl)piperazin-1-yl]carbonyl}-1-methylpyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one, 2-{[4-(2-FLUOROPHENYL)PIPERAZINO]CARBONYL}-1-METHYLPYRIDO[1,2-A]PYRROLO[2,3-D]PYRIMIDIN-4(1H)-ONE
| Molecular Formula | C22H20FN5O2 |
|---|---|
| Molecular Weight | 405.16 g/mol |
| LogP | 2.2877 |
| Topological Polar Surface Area | 62.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 405.1601 |
| Heavy Atoms | 30 |
| Complexity | 1334.6168 |
Chemical Identifiers
| CAS Number | 863614-82-8 |
|---|---|
| SMILES | CN1C(=CC2=C1N=C3C=CC=CN3C2=O)C(=O)N4CCN(CC4)C5=CC=CC=C5F |
Product Overview
UPCMLD0ENAT5434306:001 (CAS 863614-82-8), with molecular formula C22H20FN5O2 and molecular weight 405.16 g/mol. IUPAC: 5-[4-(2-fluorophenyl)piperazine-1-carbonyl]-6-methyl-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaen-2-one.
Chemical Property Profile of UPCMLD0ENAT5434306:001
Property Insights of UPCMLD0ENAT5434306:001
The XLogP value of 2.2877 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5434306:001. The TPSA of 62.85 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5434306:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5434306:001 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT5434306:001?
The CAS number of UPCMLD0ENAT5434306:001 is 863614-82-8.
What is the molecular formula of UPCMLD0ENAT5434306:001?
The molecular formula of UPCMLD0ENAT5434306:001 is C22H20FN5O2.
What is the molecular weight of UPCMLD0ENAT5434306:001?
The molecular weight of UPCMLD0ENAT5434306:001 is 405.16 g/mol.
Where can I buy UPCMLD0ENAT5434306:001?
You can request a quote for UPCMLD0ENAT5434306:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5434306:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5434306:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.