1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione
TL;DR: 1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione (CAS 61327-80-8) is a chemical compound with molecular formula C14H19ClN2O3 and molecular weight 298.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione
Also Known As: 1-(2-chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione, 1-(2-chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazi, 1-(2-Chloroethyl)-5-(cyclohex-1-en-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione
| Molecular Formula | C14H19ClN2O3 |
|---|---|
| Molecular Weight | 298.11 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.10843 |
| Heavy Atoms | 20 |
| Complexity | 489.0 |
Chemical Identifiers
| CAS Number | 61327-80-8 |
|---|---|
| SMILES | CC1(C(=O)N(C(=O)N(C1=O)CCCl)C)C2=CCCCC2 |
| InChIKey | UCNNPDYOZLTWPY-UHFFFAOYSA-N |
Product Overview
1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione (CAS 61327-80-8), with molecular formula C14H19ClN2O3 and molecular weight 298.11 g/mol. IUPAC: 1-(2-chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione
Property Insights of 1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione. With a topological polar surface area (TPSA) of 57.7 Ų, 1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione has 0 hydrogen bond donor(s) and 3 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 1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione?
The CAS number of 1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione is 61327-80-8.
What is the molecular formula of 1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione?
The molecular formula of 1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione is C14H19ClN2O3.
What is the molecular weight of 1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione?
The molecular weight of 1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione is 298.11 g/mol.
Where can I buy 1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione?
You can request a quote for 1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Chloroethyl)-5-(cyclohexen-1-yl)-3,5-dimethyl-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.