M-1 (beta)
TL;DR: M-1 (beta) (CAS 145594-64-5) is a chemical compound with molecular formula C19H22N2O7 and molecular weight 390.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-O-[(2R)-2-hydroxypropyl] 3-O-methyl (4S)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: M-1 (beta), 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(2-nitrophenyl)-, 2-hydroxypropyl methyl ester, (R*,S*)-(+-)-, 5-O-[(2R)-2-hydroxypropyl] 3-O-methyl (4S)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, (2R)-2-Hydroxypropyl methyl (4S)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, (4S)-1,4-Dihydro-2,6-dimethyl-4-(2-nitrophenyl)-3,5-pyridinedicarboxylic acid 3-methyl 5-[(R)-2-hydroxypropyl] ester
| Molecular Formula | C19H22N2O7 |
|---|---|
| Molecular Weight | 390.14 g/mol |
| LogP | 1.9266 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 390.1427 |
| Heavy Atoms | 28 |
| Complexity | 870.788 |
Chemical Identifiers
| CAS Number | 145594-64-5 |
|---|---|
| SMILES | CC1=C([C@@H](C(=C(N1)C)C(=O)OC[C@@H](C)O)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC |
Product Overview
M-1 (beta) (CAS 145594-64-5), with molecular formula C19H22N2O7 and molecular weight 390.14 g/mol. IUPAC: 5-O-[(2R)-2-hydroxypropyl] 3-O-methyl (4S)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of M-1 (beta)
Property Insights of M-1 (beta)
The XLogP value of 1.9266 suggests moderate lipophilicity, balancing water solubility and membrane permeability for M-1 (beta). The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for M-1 (beta). Following Lipinski's Rule of Five, M-1 (beta) has 2 hydrogen bond donor(s) and 8 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 M-1 (beta)?
The CAS number of M-1 (beta) is 145594-64-5.
What is the molecular formula of M-1 (beta)?
The molecular formula of M-1 (beta) is C19H22N2O7.
What is the molecular weight of M-1 (beta)?
The molecular weight of M-1 (beta) is 390.14 g/mol.
Where can I buy M-1 (beta)?
You can request a quote for M-1 (beta) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for M-1 (beta)?
Yes, KEHONG BIO provides custom synthesis services for M-1 (beta) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.