A2920/0122991
TL;DR: A2920/0122991 (CAS 1031262-87-9) is a chemical compound with molecular formula C22H29N4O2S+ and molecular weight 413.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridinyl]sulfanyl]ethyl-dimethyl-[2-(3-methylanilino)-2-oxoethyl]azanium
Also Known As: A2920/0122991, N-(2-{[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]sulfanyl}ethyl)-N,N-dimethyl-2-[(3-methylphenyl)amino]-2-oxoethanaminium, (2-{[3-CYANO-4-(METHOXYMETHYL)-6-METHYLPYRIDIN-2-YL]SULFANYL}ETHYL)DIMETHYL{[(3-METHYLPHENYL)CARBAMOYL]METHYL}AZANIUM, 2-[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]sulfanylethyl-dimethyl-[2-(3-methylanilino)-2-oxoethyl]azanium, N-[2-[[3-Cyano-4-(methoxymethyl)-6-methyl-2-pyridinyl]thio]ethyl]-N,N-dimethyl-2-[(3-methylphenyl)amino]-2-oxoethanaminium
| Molecular Formula | C22H29N4O2S+ |
|---|---|
| Molecular Weight | 413.20 g/mol |
| LogP | 3.52372 |
| Topological Polar Surface Area | 75.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 413.2011 |
| Heavy Atoms | 29 |
| Complexity | 906.17065 |
Chemical Identifiers
| CAS Number | 1031262-87-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)C[N+](C)(C)CCSC2=NC(=CC(=C2C#N)COC)C |
Product Overview
A2920/0122991 (CAS 1031262-87-9), with molecular formula C22H29N4O2S+ and molecular weight 413.20 g/mol. IUPAC: 2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridinyl]sulfanyl]ethyl-dimethyl-[2-(3-methylanilino)-2-oxoethyl]azanium.
Chemical Property Profile of A2920/0122991
Property Insights of A2920/0122991
The XLogP value of 3.52372 indicates that A2920/0122991 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.01 Ų falls within the moderate polarity range, balancing permeability and solubility for A2920/0122991. Following Lipinski's Rule of Five, A2920/0122991 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A2920/0122991?
The CAS number of A2920/0122991 is 1031262-87-9.
What is the molecular formula of A2920/0122991?
The molecular formula of A2920/0122991 is C22H29N4O2S+.
What is the molecular weight of A2920/0122991?
The molecular weight of A2920/0122991 is 413.20 g/mol.
Where can I buy A2920/0122991?
You can request a quote for A2920/0122991 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2920/0122991?
Yes, KEHONG BIO provides custom synthesis services for A2920/0122991 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.