NK 250
TL;DR: NK 250 (CAS 148416-85-7) is a chemical compound with molecular formula C26H27N3O4S2 and molecular weight 509.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
NK 250
bis(pyridin-4-ylmethyl) 2,6-dimethyl-4-(6-methyl-2,3-dihydro-1,4-dithiin-5-yl)-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: NK 250, NIK250, NCI60_020780, bis(pyridin-4-ylmethyl) 2,6-dimethyl-4-(6-methyl-2,3-dihydro-1,4-dithiin-5-yl)-1,4-dihydropyridine-3,5-dicarboxylate, 2,6-Dimethyl-1,4-dihydro-4-[(5,6-dihydro-3-methyl-1,4-dithiin)-2-yl]-3,5-pyridinedicarboxylic acid bis[(pyridin-4-yl)methyl] ester
| Molecular Formula | C26H27N3O4S2 |
|---|---|
| Molecular Weight | 509.14 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 509.1443 |
| Heavy Atoms | 35 |
| Complexity | 846.0 |
Chemical Identifiers
| CAS Number | 148416-85-7 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)OCC2=CC=NC=C2)C3=C(SCCS3)C)C(=O)OCC4=CC=NC=C4 |
| InChIKey | WKCXIRURXIDOND-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
NK 250 (CAS 148416-85-7), with molecular formula C26H27N3O4S2 and molecular weight 509.14 g/mol. IUPAC: bis(pyridin-4-ylmethyl) 2,6-dimethyl-4-(6-methyl-2,3-dihydro-1,4-dithiin-5-yl)-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of NK 250
Property Insights of NK 250
The XLogP value of 3.2 indicates that NK 250 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting NK 250 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, NK 250 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of NK 250?
The CAS number of NK 250 is 148416-85-7.
What is the molecular formula of NK 250?
The molecular formula of NK 250 is C26H27N3O4S2.
What is the molecular weight of NK 250?
The molecular weight of NK 250 is 509.14 g/mol.
Where can I buy NK 250?
You can request a quote for NK 250 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NK 250?
Yes, KEHONG BIO provides custom synthesis services for NK 250 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.