ChemDiv1_003140
TL;DR: ChemDiv1_003140 (CAS 127531-82-2) is a chemical compound with molecular formula C16H18Cl2N8O and molecular weight 408.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-3-(3,4-dichlorophenyl)-2-iminoimidazolidin-4-one
Also Known As: ChemDiv1_003140, BAS 00216382, 1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-3-(3,4-dichlorophenyl)-2-iminoimidazolidin-4-one, 1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-3-(3,4-dichlorophenyl)-2-imino-4-imidazolidinone, BRD-K11788058-001-01-1
| Molecular Formula | C16H18Cl2N8O |
|---|---|
| Molecular Weight | 408.10 g/mol |
| LogP | 2.09837 |
| Topological Polar Surface Area | 92.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 408.09805 |
| Heavy Atoms | 27 |
| Complexity | 891.03845 |
Chemical Identifiers
| CAS Number | 127531-82-2 |
|---|---|
| SMILES | CN(C)C1=NC(=NC(=N1)N2CC(=O)N(C2=N)C3=CC(=C(C=C3)Cl)Cl)N(C)C |
Product Overview
ChemDiv1_003140 (CAS 127531-82-2), with molecular formula C16H18Cl2N8O and molecular weight 408.10 g/mol. IUPAC: 1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-3-(3,4-dichlorophenyl)-2-iminoimidazolidin-4-one.
Chemical Property Profile of ChemDiv1_003140
Property Insights of ChemDiv1_003140
The XLogP value of 2.09837 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_003140. The TPSA of 92.55 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_003140. Following Lipinski's Rule of Five, ChemDiv1_003140 has 1 hydrogen bond donor(s) and 7 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 ChemDiv1_003140?
The CAS number of ChemDiv1_003140 is 127531-82-2.
What is the molecular formula of ChemDiv1_003140?
The molecular formula of ChemDiv1_003140 is C16H18Cl2N8O.
What is the molecular weight of ChemDiv1_003140?
The molecular weight of ChemDiv1_003140 is 408.10 g/mol.
Where can I buy ChemDiv1_003140?
You can request a quote for ChemDiv1_003140 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_003140?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_003140 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.