UPCMLD0ENAT5761946:001
TL;DR: UPCMLD0ENAT5761946:001 (CAS 385389-74-2) is a chemical compound with molecular formula C21H21N5 and molecular weight 343.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-imidazol-1-yl-3-methyl-2-(3-methylbutyl)pyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: UPCMLD0ENAT5761946:001, 1-(1H-imidazol-1-yl)-3-methyl-2-(3-methylbutyl)pyrido[1,2-a]benzimidazole-4-carbonitrile, 1-(1H-imidazol-1-yl)-2-isopentyl-3-methylbenzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 1-(1H-imidazol-1-yl)-2-isopentyl-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile, 1-imidazol-1-yl-3-methyl-2-(3-methylbutyl)pyrido[1,2-a]benzimidazole-4-carbonitrile
| Molecular Formula | C21H21N5 |
|---|---|
| Molecular Weight | 343.18 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.1797 |
| Heavy Atoms | 26 |
| Complexity | 540.0 |
Chemical Identifiers
| CAS Number | 385389-74-2 |
|---|---|
| SMILES | CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC(C)C)N4C=CN=C4)C#N |
| InChIKey | VICOLIDMSHIBIZ-UHFFFAOYSA-N |
Product Overview
UPCMLD0ENAT5761946:001 (CAS 385389-74-2), with molecular formula C21H21N5 and molecular weight 343.18 g/mol. IUPAC: 1-imidazol-1-yl-3-methyl-2-(3-methylbutyl)pyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of UPCMLD0ENAT5761946:001
Property Insights of UPCMLD0ENAT5761946:001
The XLogP value of 5.5 indicates that UPCMLD0ENAT5761946:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.9 Ų, UPCMLD0ENAT5761946:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT5761946:001 has 0 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 UPCMLD0ENAT5761946:001?
The CAS number of UPCMLD0ENAT5761946:001 is 385389-74-2.
What is the molecular formula of UPCMLD0ENAT5761946:001?
The molecular formula of UPCMLD0ENAT5761946:001 is C21H21N5.
What is the molecular weight of UPCMLD0ENAT5761946:001?
The molecular weight of UPCMLD0ENAT5761946:001 is 343.18 g/mol.
Where can I buy UPCMLD0ENAT5761946:001?
You can request a quote for UPCMLD0ENAT5761946:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5761946:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5761946:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.