Nbd-ocpc
TL;DR: Nbd-ocpc (CAS 99566-32-2) is a chemical compound with molecular formula C38H64N5O11P and molecular weight 797.43 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[6-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]hexanoyloxy]-3-[(Z)-octadec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Also Known As: Nbd-ocpc, 1-Oleoyl-2-nbd-6-aminocaproyl-sn-glycero-3-phosphocholine, 1-Oleoyl-2-(7-(4-nitrobenzo-2-oxa-1,3-diazole))-6-aminocaproylphosphatidylcholine, [2-[6-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]hexanoyloxy]-3-[(Z)-octadec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate, 4-Hydroxy-N,N,N-trimethyl-7-((6-((7-nitro-4-benzofurazanyl)amino)-1-oxohexyl)oxy)-10-oxo-3,5,9-trioxa-4-phosphaheptacos-18-en-1-aminium hydroxide, inner salt, 4-oxide, (Z)-
| Molecular Formula | C38H64N5O11P |
|---|---|
| Molecular Weight | 797.43 g/mol |
| LogP | 7.8036 |
| Topological Polar Surface Area | 205.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 33 |
| Exact Mass | 797.434 |
| Heavy Atoms | 55 |
| Complexity | 1480.4209 |
Chemical Identifiers
| CAS Number | 99566-32-2 |
|---|---|
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCNC1=CC=C(C2=NON=C12)[N+](=O)[O-] |
Product Overview
Nbd-ocpc (CAS 99566-32-2), with molecular formula C38H64N5O11P and molecular weight 797.43 g/mol. IUPAC: [2-[6-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]hexanoyloxy]-3-[(Z)-octadec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate.
Chemical Property Profile of Nbd-ocpc
Property Insights of Nbd-ocpc
The XLogP value of 7.8036 indicates that Nbd-ocpc is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 205.28 Ų indicates high polarity, suggesting Nbd-ocpc may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Nbd-ocpc has 1 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Nbd-ocpc?
The CAS number of Nbd-ocpc is 99566-32-2.
What is the molecular formula of Nbd-ocpc?
The molecular formula of Nbd-ocpc is C38H64N5O11P.
What is the molecular weight of Nbd-ocpc?
The molecular weight of Nbd-ocpc is 797.43 g/mol.
Where can I buy Nbd-ocpc?
You can request a quote for Nbd-ocpc directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nbd-ocpc?
Yes, KEHONG BIO provides custom synthesis services for Nbd-ocpc and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.