TimTec1_007963
TL;DR: TimTec1_007963 (CAS 1008039-16-4) is a chemical compound with molecular formula C16H14Cl2N4O4 and molecular weight 396.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[[1-(2,4-dichlorophenyl)-2,5-dioxopyrrolidin-3-yl]amino]-1,3-dimethylpyrimidine-2,4-dione
Also Known As: TimTec1_007963, IDI1_033617, BAS 05590553, 6-[[1-(2,4-dichlorophenyl)-2,5-dioxopyrrolidin-3-yl]amino]-1,3-dimethylpyrimidine-2,4-dione, 6-{[1-(2,4-dichlorophenyl)-2,5-dioxoazolidin-3-yl]amino}-1,3-dimethyl-1,3-dihy dropyrimidine-2,4-dione
| Molecular Formula | C16H14Cl2N4O4 |
|---|---|
| Molecular Weight | 396.04 g/mol |
| LogP | 1.1348 |
| Topological Polar Surface Area | 93.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 396.0392 |
| Heavy Atoms | 26 |
| Complexity | 1043.5209 |
Chemical Identifiers
| CAS Number | 1008039-16-4 |
|---|---|
| SMILES | CN1C(=CC(=O)N(C1=O)C)NC2CC(=O)N(C2=O)C3=C(C=C(C=C3)Cl)Cl |
Product Overview
TimTec1_007963 (CAS 1008039-16-4), with molecular formula C16H14Cl2N4O4 and molecular weight 396.04 g/mol. IUPAC: 6-[[1-(2,4-dichlorophenyl)-2,5-dioxopyrrolidin-3-yl]amino]-1,3-dimethylpyrimidine-2,4-dione.
Chemical Property Profile of TimTec1_007963
Property Insights of TimTec1_007963
The XLogP value of 1.1348 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TimTec1_007963. The TPSA of 93.41 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_007963. Following Lipinski's Rule of Five, TimTec1_007963 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 TimTec1_007963?
The CAS number of TimTec1_007963 is 1008039-16-4.
What is the molecular formula of TimTec1_007963?
The molecular formula of TimTec1_007963 is C16H14Cl2N4O4.
What is the molecular weight of TimTec1_007963?
The molecular weight of TimTec1_007963 is 396.04 g/mol.
Where can I buy TimTec1_007963?
You can request a quote for TimTec1_007963 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_007963?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_007963 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.