Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one
TL;DR: Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one (CAS 30805-38-0) is a chemical compound with molecular formula C9H19N3O and molecular weight 185.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-di(propan-2-yl)-1,3,5-triazinan-2-one
Also Known As: 4,6-di(propan-2-yl)-1,3,5-triazinan-2-one, TETRAHYDRO-4,6-DIISOPROPYL-S-TRIAZIN-2(1H)-ONE, J1.615.063K, 4,6-bis(propan-2-yl)-1,3,5-triazinan-2-one, 3,4,5,6-Tetrahydro-4,6-diisopropyl-s-triazine-2(1H)-one
| Molecular Formula | C9H19N3O |
|---|---|
| Molecular Weight | 185.15 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 53.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 185.15282 |
| Heavy Atoms | 13 |
| Complexity | 173.0 |
Chemical Identifiers
| CAS Number | 30805-38-0 |
|---|---|
| SMILES | CC(C)C1NC(NC(=O)N1)C(C)C |
| InChIKey | RNBQTUYBVNJSMA-UHFFFAOYSA-N |
Product Overview
Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one (CAS 30805-38-0), with molecular formula C9H19N3O and molecular weight 185.15 g/mol. IUPAC: 4,6-di(propan-2-yl)-1,3,5-triazinan-2-one.
Chemical Property Profile of Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one
Property Insights of Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one. With a topological polar surface area (TPSA) of 53.2 Ų, Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one has 3 hydrogen bond donor(s) and 2 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 Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one?
The CAS number of Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one is 30805-38-0.
What is the molecular formula of Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one?
The molecular formula of Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one is C9H19N3O.
What is the molecular weight of Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one?
The molecular weight of Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one is 185.15 g/mol.
Where can I buy Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one?
You can request a quote for Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.