UPCMLD0ENAT5752247:001
TL;DR: UPCMLD0ENAT5752247:001 (CAS 383902-34-9) is a chemical compound with molecular formula C31H31N5O and molecular weight 489.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(2-naphthalen-1-yloxyethyl)piperazin-1-yl]-3-propylpyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: UPCMLD0ENAT5752247:001, 1-{4-[2-(naphthalen-1-yloxy)ethyl]piperazin-1-yl}-3-propylpyrido[1,2-a]benzimidazole-4-carbonitrile, 1-(4-(2-(naphthalen-1-yloxy)ethyl)piperazin-1-yl)-3-propylbenzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 1-[4-(2-naphthalen-1-yloxyethyl)piperazin-1-yl]-3-propylpyrido[1,2-a]benzimidazole-4-carbonitrile, 1-{4-[2-(1-naphthyloxy)ethyl]-1-piperazinyl}-3-propylpyrido[1,2-a]benzimidazole-4-carbonitrile
| Molecular Formula | C31H31N5O |
|---|---|
| Molecular Weight | 489.25 g/mol |
| LogP | 5.66588 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 489.25287 |
| Heavy Atoms | 37 |
| Complexity | 1602.1752 |
Chemical Identifiers
| CAS Number | 383902-34-9 |
|---|---|
| SMILES | CCCC1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CCN(CC4)CCOC5=CC=CC6=CC=CC=C65)C#N |
Product Overview
UPCMLD0ENAT5752247:001 (CAS 383902-34-9), with molecular formula C31H31N5O and molecular weight 489.25 g/mol. IUPAC: 1-[4-(2-naphthalen-1-yloxyethyl)piperazin-1-yl]-3-propylpyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of UPCMLD0ENAT5752247:001
Property Insights of UPCMLD0ENAT5752247:001
The XLogP value of 5.66588 indicates that UPCMLD0ENAT5752247:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.8 Ų, UPCMLD0ENAT5752247:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT5752247:001 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 UPCMLD0ENAT5752247:001?
The CAS number of UPCMLD0ENAT5752247:001 is 383902-34-9.
What is the molecular formula of UPCMLD0ENAT5752247:001?
The molecular formula of UPCMLD0ENAT5752247:001 is C31H31N5O.
What is the molecular weight of UPCMLD0ENAT5752247:001?
The molecular weight of UPCMLD0ENAT5752247:001 is 489.25 g/mol.
Where can I buy UPCMLD0ENAT5752247:001?
You can request a quote for UPCMLD0ENAT5752247:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5752247:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5752247:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.