UPCMLD0ENAT5755253:001
TL;DR: UPCMLD0ENAT5755253:001 (CAS 850186-50-4) is a chemical compound with molecular formula C27H27N5 and molecular weight 421.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-1-[4-(4-methylphenyl)piperazin-1-yl]-2-prop-2-enylpyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: UPCMLD0ENAT5755253:001, 2-allyl-3-methyl-1-(4-(p-tolyl)piperazin-1-yl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 2-ALLYL-3-METHYL-1-[4-(4-METHYLPHENYL)PIPERAZINO]PYRIDO[1,2-A][1,3]BENZIMIDAZOL-4-YL CYANIDE, 2-methyl-4-[4-(4-methylphenyl)piperazinyl]-3-prop-2-enyl-5-hydropyridino[1,2-a ]benzimidazolecarbonitrile, 3-methyl-1-[4-(4-methylphenyl)piperazin-1-yl]-2-(prop-2-en-1-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile
| Molecular Formula | C27H27N5 |
|---|---|
| Molecular Weight | 421.23 g/mol |
| LogP | 5.03112 |
| Topological Polar Surface Area | 47.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 421.22665 |
| Heavy Atoms | 32 |
| Complexity | 1349.3275 |
Chemical Identifiers
| CAS Number | 850186-50-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=C(C4=NC5=CC=CC=C5N34)C#N)C)CC=C |
Product Overview
UPCMLD0ENAT5755253:001 (CAS 850186-50-4), with molecular formula C27H27N5 and molecular weight 421.23 g/mol. IUPAC: 3-methyl-1-[4-(4-methylphenyl)piperazin-1-yl]-2-prop-2-enylpyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of UPCMLD0ENAT5755253:001
Property Insights of UPCMLD0ENAT5755253:001
The XLogP value of 5.03112 indicates that UPCMLD0ENAT5755253:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.57 Ų, UPCMLD0ENAT5755253:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT5755253:001 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 UPCMLD0ENAT5755253:001?
The CAS number of UPCMLD0ENAT5755253:001 is 850186-50-4.
What is the molecular formula of UPCMLD0ENAT5755253:001?
The molecular formula of UPCMLD0ENAT5755253:001 is C27H27N5.
What is the molecular weight of UPCMLD0ENAT5755253:001?
The molecular weight of UPCMLD0ENAT5755253:001 is 421.23 g/mol.
Where can I buy UPCMLD0ENAT5755253:001?
You can request a quote for UPCMLD0ENAT5755253:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5755253:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5755253:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.