3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)-
TL;DR: 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)- (CAS 160455-70-9) is a chemical compound with molecular formula C11H17N3O3 and molecular weight 239.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-bis(oxiran-2-ylmethyl)-5-propan-2-yl-1,2,4-triazol-3-one
Also Known As: 2,4-Dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)-3H-1,2,4-triazol-3-one, 2,4-bis(oxiran-2-ylmethyl)-5-propan-2-yl-1,2,4-triazol-3-one, 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)-, 1,4-Diglycidyl-3-isopropyl-1H-1,2,4-triazol-5(4H)-one, 1,4-bis[(oxiran-2-yl)methyl]-3-(propan-2-yl)-4,5-dihydro-1H-1,2,4-triazol-5-one
| Molecular Formula | C11H17N3O3 |
|---|---|
| Molecular Weight | 239.13 g/mol |
| LogP | -0.0342 |
| Topological Polar Surface Area | 64.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 239.127 |
| Heavy Atoms | 17 |
| Complexity | 468.79648 |
Chemical Identifiers
| CAS Number | 160455-70-9 |
|---|---|
| SMILES | CC(C)C1=NN(C(=O)N1CC2CO2)CC3CO3 |
Product Overview
3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)- (CAS 160455-70-9), with molecular formula C11H17N3O3 and molecular weight 239.13 g/mol. IUPAC: 2,4-bis(oxiran-2-ylmethyl)-5-propan-2-yl-1,2,4-triazol-3-one.
Chemical Property Profile of 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)-
Property Insights of 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)-
The XLogP value of -0.0342 indicates that 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 64.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)-. Following Lipinski's Rule of Five, 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)- has 0 hydrogen bond donor(s) and 4 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 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)-?
The CAS number of 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)- is 160455-70-9.
What is the molecular formula of 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)-?
The molecular formula of 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)- is C11H17N3O3.
What is the molecular weight of 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)-?
The molecular weight of 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)- is 239.13 g/mol.
Where can I buy 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)-?
You can request a quote for 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.