NIP 121
TL;DR: NIP 121 (CAS 135244-62-1) is a chemical compound with molecular formula C16H19N3O4 and molecular weight 317.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(7R,8S)-7-hydroxy-6,6-dimethyl-7,8-dihydropyrano[2,3-f][2,1,3]benzoxadiazol-8-yl]piperidin-2-one
Also Known As: NIP 121, NIP 1, 2-Piperidinone, 1-(7,8-dihydro-7-hydroxy-6,6-dimethyl-6H-pyrano(2,3-f)-2,1,3-benzoxadiazol-8-yl)-, trans-(+)-, 7,8-Dihydro-6,6-dimethyl-7-hydroxy-8-(2-oxo-piperidin-1-yl)-6H-pyrano(2,3)benz-2,1,3-oxadiazole, 1-[(7R,8S)-7-hydroxy-6,6-dimethyl-7,8-dihydropyrano[2,3-f][2,1,3]benzoxadiazol-8-yl]piperidin-2-one
| Molecular Formula | C16H19N3O4 |
|---|---|
| Molecular Weight | 317.14 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 88.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 317.13754 |
| Heavy Atoms | 23 |
| Complexity | 486.0 |
Chemical Identifiers
| CAS Number | 135244-62-1 |
|---|---|
| SMILES | CC1([C@@H]([C@H](C2=CC3=NON=C3C=C2O1)N4CCCCC4=O)O)C |
| InChIKey | KMXPHBJUGYLXDM-LSDHHAIUSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
NIP 121 (CAS 135244-62-1), with molecular formula C16H19N3O4 and molecular weight 317.14 g/mol. IUPAC: 1-[(7R,8S)-7-hydroxy-6,6-dimethyl-7,8-dihydropyrano[2,3-f][2,1,3]benzoxadiazol-8-yl]piperidin-2-one.
Chemical Property Profile of NIP 121
Property Insights of NIP 121
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for NIP 121. The TPSA of 88.7 Ų falls within the moderate polarity range, balancing permeability and solubility for NIP 121. Following Lipinski's Rule of Five, NIP 121 has 1 hydrogen bond donor(s) and 6 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 NIP 121?
The CAS number of NIP 121 is 135244-62-1.
What is the molecular formula of NIP 121?
The molecular formula of NIP 121 is C16H19N3O4.
What is the molecular weight of NIP 121?
The molecular weight of NIP 121 is 317.14 g/mol.
Where can I buy NIP 121?
You can request a quote for NIP 121 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NIP 121?
Yes, KEHONG BIO provides custom synthesis services for NIP 121 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.