UPCMLD0ENAT5755264:001
TL;DR: UPCMLD0ENAT5755264:001 (CAS 849825-63-4) is a chemical compound with molecular formula C27H25Cl2N5 and molecular weight 489.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]-3-methyl-2-prop-2-enylpyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: UPCMLD0ENAT5755264:001, 1-[4-(3,4-dichlorobenzyl)piperazin-1-yl]-3-methyl-2-(prop-2-en-1-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile, 1-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]-3-methyl-2-prop-2-enylpyrido[1,2-a]benzimidazole-4-carbonitrile, 2-allyl-1-(4-(3,4-dichlorobenzyl)piperazin-1-yl)-3-methylbenzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 4-{4-[(3,4-dichlorophenyl)methyl]piperazinyl}-2-methyl-3-prop-2-enyl-5-hydropy ridino[1,2-a]benzimidazolecarbonitrile
| Molecular Formula | C27H25Cl2N5 |
|---|---|
| Molecular Weight | 489.15 g/mol |
| LogP | 6.0251 |
| Topological Polar Surface Area | 47.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 489.1487 |
| Heavy Atoms | 34 |
| Complexity | 1441.443 |
Chemical Identifiers
| CAS Number | 849825-63-4 |
|---|---|
| SMILES | CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC=C)N4CCN(CC4)CC5=CC(=C(C=C5)Cl)Cl)C#N |
Product Overview
UPCMLD0ENAT5755264:001 (CAS 849825-63-4), with molecular formula C27H25Cl2N5 and molecular weight 489.15 g/mol. IUPAC: 1-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]-3-methyl-2-prop-2-enylpyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of UPCMLD0ENAT5755264:001
Property Insights of UPCMLD0ENAT5755264:001
The XLogP value of 6.0251 indicates that UPCMLD0ENAT5755264:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.57 Ų, UPCMLD0ENAT5755264:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT5755264:001 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 UPCMLD0ENAT5755264:001?
The CAS number of UPCMLD0ENAT5755264:001 is 849825-63-4.
What is the molecular formula of UPCMLD0ENAT5755264:001?
The molecular formula of UPCMLD0ENAT5755264:001 is C27H25Cl2N5.
What is the molecular weight of UPCMLD0ENAT5755264:001?
The molecular weight of UPCMLD0ENAT5755264:001 is 489.15 g/mol.
Where can I buy UPCMLD0ENAT5755264:001?
You can request a quote for UPCMLD0ENAT5755264:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5755264:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5755264:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.