Bmy 20064
TL;DR: Bmy 20064 (CAS 100305-59-7) is a chemical compound with molecular formula C30H36N4O7 and molecular weight 564.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-O-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl] 5-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-2,5-dihydropyridine-3,5-dicarboxylate
Also Known As: Bmy 20064, 3-O-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl] 5-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-2,5-dihydropyridine-3,5-dicarboxylate, 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 3-(4-(2-methoxyphenyl)-1-piperazinyl)propyl methyl ester, 3,5-Pyridinedicarboxylic acid,1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-,3-(4-(2-methoxyphenyl)-1-piperazinyl)propyl methyl ester, 3-{3-[4-(2-Methoxyphenyl)piperazin-1-yl]propyl} 5-methyl 2,6-dimethyl-4-(3-nitrophenyl)-2,5-dihydropyridine-3,5-dicarboxylate
| Molecular Formula | C30H36N4O7 |
|---|---|
| Molecular Weight | 564.26 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 11 |
| Exact Mass | 564.2584 |
| Heavy Atoms | 41 |
| Complexity | 1000.0 |
Chemical Identifiers
| CAS Number | 100305-59-7 |
|---|---|
| SMILES | CC1C(=C(C(C(=N1)C)C(=O)OC)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCCN3CCN(CC3)C4=CC=CC=C4OC |
| InChIKey | QADWEQVSNYLMRN-UHFFFAOYSA-N |
Product Overview
Bmy 20064 (CAS 100305-59-7), with molecular formula C30H36N4O7 and molecular weight 564.26 g/mol. IUPAC: 3-O-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl] 5-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-2,5-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of Bmy 20064
Property Insights of Bmy 20064
The XLogP value of 3.5 indicates that Bmy 20064 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bmy 20064. Following Lipinski's Rule of Five, Bmy 20064 has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bmy 20064?
The CAS number of Bmy 20064 is 100305-59-7.
What is the molecular formula of Bmy 20064?
The molecular formula of Bmy 20064 is C30H36N4O7.
What is the molecular weight of Bmy 20064?
The molecular weight of Bmy 20064 is 564.26 g/mol.
Where can I buy Bmy 20064?
You can request a quote for Bmy 20064 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bmy 20064?
Yes, KEHONG BIO provides custom synthesis services for Bmy 20064 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.