UPCMLD0ENAT5742629:001
TL;DR: UPCMLD0ENAT5742629:001 (CAS 497942-39-9) is a chemical compound with molecular formula C32H33N5 and molecular weight 487.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butyl-3-methyl-1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: UPCMLD0ENAT5742629:001, 2-butyl-3-methyl-1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile, 2-butyl-3-methyl-1-(4-(naphthalen-1-ylmethyl)piperazin-1-yl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 2-BUTYL-3-METHYL-1-[4-(1-NAPHTHYLMETHYL)-1-PIPERAZINYL]PYRIDO[1,2-A]BENZIMIDAZOLE-4-CARBONITRILE, 3-butyl-2-methyl-4-[4-(naphthylmethyl)piperazinyl]-5-hydropyridino[1,2-a]benzi midazolecarbonitrile
| Molecular Formula | C32H33N5 |
|---|---|
| Molecular Weight | 487.27 g/mol |
| LogP | 6.4856 |
| Topological Polar Surface Area | 47.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 487.2736 |
| Heavy Atoms | 37 |
| Complexity | 1627.5177 |
Chemical Identifiers
| CAS Number | 497942-39-9 |
|---|---|
| SMILES | CCCCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)N4CCN(CC4)CC5=CC=CC6=CC=CC=C65 |
Product Overview
UPCMLD0ENAT5742629:001 (CAS 497942-39-9), with molecular formula C32H33N5 and molecular weight 487.27 g/mol. IUPAC: 2-butyl-3-methyl-1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of UPCMLD0ENAT5742629:001
Property Insights of UPCMLD0ENAT5742629:001
The XLogP value of 6.4856 indicates that UPCMLD0ENAT5742629:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.57 Ų, UPCMLD0ENAT5742629:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT5742629:001 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 UPCMLD0ENAT5742629:001?
The CAS number of UPCMLD0ENAT5742629:001 is 497942-39-9.
What is the molecular formula of UPCMLD0ENAT5742629:001?
The molecular formula of UPCMLD0ENAT5742629:001 is C32H33N5.
What is the molecular weight of UPCMLD0ENAT5742629:001?
The molecular weight of UPCMLD0ENAT5742629:001 is 487.27 g/mol.
Where can I buy UPCMLD0ENAT5742629:001?
You can request a quote for UPCMLD0ENAT5742629:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5742629:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5742629:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.