(S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane
TL;DR: (S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane (CAS 959574-91-5) is a chemical compound with molecular formula C19H30N2O2 and molecular weight 318.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-methyl-N-[(2S)-3-methyl-1-pyrrolidin-1-ylpentan-2-yl]carbamate
Also Known As: (S)-1-PYRROLIDIN-2-ISOBUTYL-2-(N-CBZ-N-METHYL)AMINO-ETHANE, X-1713, -1-PYRROLIDIN-2-ISOBUTYL-2- AMINO-ETHANE, benzyl N-methyl-N-[(2S)-3-methyl-1-pyrrolidin-1-ylpentan-2-yl]carbamate, (S)-1-Pyrrolidin-2-isobutyll-2-(N-Cbz-N-Methyl)amino-ethane
| Molecular Formula | C19H30N2O2 |
|---|---|
| Molecular Weight | 318.23 g/mol |
| LogP | 3.7655 |
| Topological Polar Surface Area | 32.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 318.23074 |
| Heavy Atoms | 23 |
| Complexity | 471.51776 |
Chemical Identifiers
| CAS Number | 959574-91-5 |
|---|---|
| SMILES | CCC(C)[C@@H](CN1CCCC1)N(C)C(=O)OCC2=CC=CC=C2 |
Product Overview
(S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane (CAS 959574-91-5), with molecular formula C19H30N2O2 and molecular weight 318.23 g/mol. IUPAC: benzyl N-methyl-N-[(2S)-3-methyl-1-pyrrolidin-1-ylpentan-2-yl]carbamate.
Chemical Property Profile of (S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane
Property Insights of (S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane
The XLogP value of 3.7655 indicates that (S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.78 Ų, (S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane 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 (S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane?
The CAS number of (S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane is 959574-91-5.
What is the molecular formula of (S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane?
The molecular formula of (S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane is C19H30N2O2.
What is the molecular weight of (S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane?
The molecular weight of (S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane is 318.23 g/mol.
Where can I buy (S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane?
You can request a quote for (S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane?
Yes, KEHONG BIO provides custom synthesis services for (S)-1-Pyrrolidin-2-isobutyl-2-(N-cbz-N-methyl)amino-ethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.