AF-399/34134006
TL;DR: AF-399/34134006 (CAS 314027-90-2) is a chemical compound with molecular formula C25H23N3O2S and molecular weight 429.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,3-bis(2,3-dimethylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-imine
Also Known As: AF-399/34134006, N,3-bis(2,3-dimethylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-imine, 3-(2,3-dimethylphenyl)-2-[(2,3-dimethylphenyl)imino]-4-{4-nitrophenyl}-2,3-dihydro-1,3-thiazole, (Z)-N-(3-(2,3-dimethylphenyl)-4-(4-nitrophenyl)thiazol-2(3H)-ylidene)-2,3-dimethylaniline, 3-(2,3-dimethylphenyl)-2-[(2,3-dimethylphenyl)azamethylene]-4-(4-nitrophenyl)- 1,3-thiazoline
| Molecular Formula | C25H23N3O2S |
|---|---|
| Molecular Weight | 429.15 g/mol |
| LogP | 6.58008 |
| Topological Polar Surface Area | 60.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 429.1511 |
| Heavy Atoms | 31 |
| Complexity | 1348.1924 |
Chemical Identifiers
| CAS Number | 314027-90-2 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)N=C2N(C(=CS2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC(=C4C)C)C |
Product Overview
AF-399/34134006 (CAS 314027-90-2), with molecular formula C25H23N3O2S and molecular weight 429.15 g/mol. IUPAC: N,3-bis(2,3-dimethylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-imine.
Chemical Property Profile of AF-399/34134006
Property Insights of AF-399/34134006
The XLogP value of 6.58008 indicates that AF-399/34134006 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.43 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/34134006. Following Lipinski's Rule of Five, AF-399/34134006 has 0 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 AF-399/34134006?
The CAS number of AF-399/34134006 is 314027-90-2.
What is the molecular formula of AF-399/34134006?
The molecular formula of AF-399/34134006 is C25H23N3O2S.
What is the molecular weight of AF-399/34134006?
The molecular weight of AF-399/34134006 is 429.15 g/mol.
Where can I buy AF-399/34134006?
You can request a quote for AF-399/34134006 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/34134006?
Yes, KEHONG BIO provides custom synthesis services for AF-399/34134006 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.