UPCMLD0ENAT5748122:001
TL;DR: UPCMLD0ENAT5748122:001 (CAS 459191-37-8) is a chemical compound with molecular formula C24H22N4 and molecular weight 366.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-(3,4-dimethylanilino)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile
Also Known As: UPCMLD0ENAT5748122:001, 11-((3,4-dimethylphenyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile, 11-[(3,4-dimethylphenyl)amino]-7,8,9,10-tetrahydrobenzimidazo[1,2-b]isoquinoline-6-carbonitrile, 11-(3,4-dimethylanilino)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile, 11-[(3,4-dimethylphenyl)amino]-7,8,9,10,12-pentahydrobenzimidazolo[1,2-b]isoqu inoline-6-carbonitrile
| Molecular Formula | C24H22N4 |
|---|---|
| Molecular Weight | 366.18 g/mol |
| LogP | 5.59842 |
| Topological Polar Surface Area | 53.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 366.18445 |
| Heavy Atoms | 28 |
| Complexity | 1273.7284 |
Chemical Identifiers
| CAS Number | 459191-37-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC2=C3CCCCC3=C(C4=NC5=CC=CC=C5N24)C#N)C |
Product Overview
UPCMLD0ENAT5748122:001 (CAS 459191-37-8), with molecular formula C24H22N4 and molecular weight 366.18 g/mol. IUPAC: 11-(3,4-dimethylanilino)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile.
Chemical Property Profile of UPCMLD0ENAT5748122:001
Property Insights of UPCMLD0ENAT5748122:001
The XLogP value of 5.59842 indicates that UPCMLD0ENAT5748122:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.12 Ų, UPCMLD0ENAT5748122:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT5748122:001 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT5748122:001?
The CAS number of UPCMLD0ENAT5748122:001 is 459191-37-8.
What is the molecular formula of UPCMLD0ENAT5748122:001?
The molecular formula of UPCMLD0ENAT5748122:001 is C24H22N4.
What is the molecular weight of UPCMLD0ENAT5748122:001?
The molecular weight of UPCMLD0ENAT5748122:001 is 366.18 g/mol.
Where can I buy UPCMLD0ENAT5748122:001?
You can request a quote for UPCMLD0ENAT5748122:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5748122:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5748122:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.