(2S,3S)-nemonapride
TL;DR: (2S,3S)-nemonapride (CAS 1228666-15-6) is a chemical compound with molecular formula C21H26ClN3O2 and molecular weight 387.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2S,3S)-1-benzyl-2-methylpyrrolidin-3-yl]-5-chloro-2-methoxy-4-(methylamino)benzamide
Also Known As: nemonapride, Emonapride, Emilace, (-)-nemonapride, (2S,3S)-nemonapride
| Molecular Formula | C21H26ClN3O2 |
|---|---|
| Molecular Weight | 387.17 g/mol |
| LogP | 3.7831 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.17136 |
| Heavy Atoms | 27 |
| Complexity | 797.5138 |
Chemical Identifiers
| CAS Number | 1228666-15-6 |
|---|---|
| SMILES | C[C@H]1[C@H](CCN1CC2=CC=CC=C2)NC(=O)C3=CC(=C(C=C3OC)NC)Cl |
Product Overview
(2S,3S)-nemonapride (CAS 1228666-15-6), with molecular formula C21H26ClN3O2 and molecular weight 387.17 g/mol. IUPAC: N-[(2S,3S)-1-benzyl-2-methylpyrrolidin-3-yl]-5-chloro-2-methoxy-4-(methylamino)benzamide.
Chemical Property Profile of (2S,3S)-nemonapride
Property Insights of (2S,3S)-nemonapride
The XLogP value of 3.7831 indicates that (2S,3S)-nemonapride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.6 Ų, (2S,3S)-nemonapride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2S,3S)-nemonapride has 2 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 (2S,3S)-nemonapride?
The CAS number of (2S,3S)-nemonapride is 1228666-15-6.
What is the molecular formula of (2S,3S)-nemonapride?
The molecular formula of (2S,3S)-nemonapride is C21H26ClN3O2.
What is the molecular weight of (2S,3S)-nemonapride?
The molecular weight of (2S,3S)-nemonapride is 387.17 g/mol.
Where can I buy (2S,3S)-nemonapride?
You can request a quote for (2S,3S)-nemonapride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S,3S)-nemonapride?
Yes, KEHONG BIO provides custom synthesis services for (2S,3S)-nemonapride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.