Yan 7874
TL;DR: Yan 7874 (CAS 402940-12-9) is a chemical compound with molecular formula C23H21Cl2N3O and molecular weight 425.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dichlorophenyl)-2-[2-imino-3-[(4-methylphenyl)methyl]benzimidazol-1-yl]ethanol
Also Known As: Yan 7874, BAS 01365354, Alpha-(3,4-Dichlorophenyl)-2,3-dihydro-2-imino-3-[(4-methylphenyl)methyl]-1H-benzimidazole-1-ethanol, 1-(3,4-dichlorophenyl)-2-[2-imino-3-[(4-methylphenyl)methyl]benzimidazol-1-yl]ethanol, 1-(3,4-dichlorophenyl)-2-[2-imino-3-(4-methylbenzyl)-2,3-dihydro-1H-benzimidazol-1-yl]ethanol
| Molecular Formula | C23H21Cl2N3O |
|---|---|
| Molecular Weight | 425.11 g/mol |
| LogP | 5.31939 |
| Topological Polar Surface Area | 53.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 425.10617 |
| Heavy Atoms | 29 |
| Complexity | 1225.3358 |
Chemical Identifiers
| CAS Number | 402940-12-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C3=CC=CC=C3N(C2=N)CC(C4=CC(=C(C=C4)Cl)Cl)O |
Product Overview
Yan 7874 (CAS 402940-12-9), with molecular formula C23H21Cl2N3O and molecular weight 425.11 g/mol. IUPAC: 1-(3,4-dichlorophenyl)-2-[2-imino-3-[(4-methylphenyl)methyl]benzimidazol-1-yl]ethanol.
Chemical Property Profile of Yan 7874
Property Insights of Yan 7874
The XLogP value of 5.31939 indicates that Yan 7874 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.94 Ų, Yan 7874 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Yan 7874 has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Yan 7874?
The CAS number of Yan 7874 is 402940-12-9.
What is the molecular formula of Yan 7874?
The molecular formula of Yan 7874 is C23H21Cl2N3O.
What is the molecular weight of Yan 7874?
The molecular weight of Yan 7874 is 425.11 g/mol.
Where can I buy Yan 7874?
You can request a quote for Yan 7874 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Yan 7874?
Yes, KEHONG BIO provides custom synthesis services for Yan 7874 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.