UPCMLD0ENAT5757024:001
TL;DR: UPCMLD0ENAT5757024:001 (CAS 848932-90-1) is a chemical compound with molecular formula C27H23N5 and molecular weight 417.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-[(4-methylphenyl)methyl]-1-(pyridin-3-ylmethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: UPCMLD0ENAT5757024:001, 2-methyl-3-[(4-methylphenyl)methyl]-4-[(3-pyridylmethyl)amino]-5-hydropyridino [1,2-a]benzimidazolecarbonitrile, 3-methyl-2-(4-methylbenzyl)-1-((pyridin-3-ylmethyl)amino)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 3-methyl-2-(4-methylbenzyl)-1-[(pyridin-3-ylmethyl)amino]pyrido[1,2-a]benzimidazole-4-carbonitrile, 3-methyl-2-[(4-methylphenyl)methyl]-1-(pyridin-3-ylmethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile
| Molecular Formula | C27H23N5 |
|---|---|
| Molecular Weight | 417.20 g/mol |
| LogP | 5.57392 |
| Topological Polar Surface Area | 66.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.19534 |
| Heavy Atoms | 32 |
| Complexity | 1458.2821 |
Chemical Identifiers
| CAS Number | 848932-90-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CC2=C(N3C4=CC=CC=C4N=C3C(=C2C)C#N)NCC5=CN=CC=C5 |
Product Overview
UPCMLD0ENAT5757024:001 (CAS 848932-90-1), with molecular formula C27H23N5 and molecular weight 417.20 g/mol. IUPAC: 3-methyl-2-[(4-methylphenyl)methyl]-1-(pyridin-3-ylmethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of UPCMLD0ENAT5757024:001
Property Insights of UPCMLD0ENAT5757024:001
The XLogP value of 5.57392 indicates that UPCMLD0ENAT5757024:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.01 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5757024:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5757024:001 has 1 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 UPCMLD0ENAT5757024:001?
The CAS number of UPCMLD0ENAT5757024:001 is 848932-90-1.
What is the molecular formula of UPCMLD0ENAT5757024:001?
The molecular formula of UPCMLD0ENAT5757024:001 is C27H23N5.
What is the molecular weight of UPCMLD0ENAT5757024:001?
The molecular weight of UPCMLD0ENAT5757024:001 is 417.20 g/mol.
Where can I buy UPCMLD0ENAT5757024:001?
You can request a quote for UPCMLD0ENAT5757024:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5757024:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5757024:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.