Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate
TL;DR: Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate (CAS 129750-90-9) is a chemical compound with molecular formula C20H30N2O5 and molecular weight 378.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate
Also Known As: methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate, 1,3-Dicyclohexyl-alpha,5-dimethyl-2,4,6-trioxohexahydro-5-pyrimidineacetic acid, Hexahydro-1,3-dicyclohexyl-alpha,5-dimethyl-2,4,6-trioxo-5-pyrimidineacetic acid, 2-Methyl-2-(1,3-dicyclohexyl-2,4,6-trioxo-5-methylperhydropyrimidin-5-yl)acetic acid, 5-Pyrimidineacetic acid, hexahydro-1,3-dicyclohexyl-alpha,5-dimethyl-2,4,6-trioxo-
| Molecular Formula | C20H30N2O5 |
|---|---|
| Molecular Weight | 378.22 g/mol |
| LogP | 2.8679 |
| Topological Polar Surface Area | 83.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 378.21548 |
| Heavy Atoms | 27 |
| Complexity | 567.49335 |
Chemical Identifiers
| CAS Number | 129750-90-9 |
|---|---|
| SMILES | CC(C1C(=O)N(C(=O)N(C1=O)C2CCCCC2)C3CCCCC3)C(=O)OC |
Product Overview
Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate (CAS 129750-90-9), with molecular formula C20H30N2O5 and molecular weight 378.22 g/mol. IUPAC: methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate.
Chemical Property Profile of Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate
Property Insights of Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate
The XLogP value of 2.8679 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate. The TPSA of 83.99 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate. Following Lipinski's Rule of Five, Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate has 0 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 Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate?
The CAS number of Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate is 129750-90-9.
What is the molecular formula of Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate?
The molecular formula of Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate is C20H30N2O5.
What is the molecular weight of Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate?
The molecular weight of Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate is 378.22 g/mol.
Where can I buy Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate?
You can request a quote for Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-yl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.