1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate
TL;DR: 1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate (CAS 53716-44-2) is a chemical compound with molecular formula C20H37NO3 and molecular weight 339.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate
Also Known As: Rociverine, Rociverina, Rociverinum, Rilaten, Rociverine [INN]
| Molecular Formula | C20H37NO3 |
|---|---|
| Molecular Weight | 339.28 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 339.27734 |
| Heavy Atoms | 24 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 53716-44-2 |
|---|---|
| SMILES | CCN(CC)CC(C)OC(=O)C1CCCC[C@@]1(C2CCCCC2)O |
| InChIKey | XPYLKZZOBVLVHB-NLPFYKDJSA-N |
Product Overview
1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate (CAS 53716-44-2), with molecular formula C20H37NO3 and molecular weight 339.28 g/mol. IUPAC: 1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate.
Chemical Property Profile of 1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate
Property Insights of 1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate
The XLogP value of 4.8 indicates that 1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, 1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate has 1 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 1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate?
The CAS number of 1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate is 53716-44-2.
What is the molecular formula of 1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate?
The molecular formula of 1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate is C20H37NO3.
What is the molecular weight of 1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate?
The molecular weight of 1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate is 339.28 g/mol.
Where can I buy 1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate?
You can request a quote for 1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.