Noa-Thr(OPO3K2)-CVA-Ile-Amp
TL;DR: Noa-Thr(OPO3K2)-CVA-Ile-Amp (CAS 146394-65-2) is a chemical compound with molecular formula C43H62N5O10P and molecular weight 839.42 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S)-4-[[(3S,5S)-1-cyclohexyl-3-hydroxy-6-methyl-5-[[(3S)-3-methyl-1-oxo-1-(pyridin-2-ylmethylamino)pentan-2-yl]carbamoyl]heptan-2-yl]amino]-3-[(2-naphthalen-1-yloxyacetyl)amino]-4-oxobutan-2-yl] dihydrogen phosphate
Also Known As: Noa-Thr(OPO3K2)-CVA-Ile-Amp, [(2S)-3-[[(2S,4S)-1-(cyclohexylmethyl)-2-hydroxy-5-methyl-4-[[(2S)-2-methyl-1-(2-pyridylmethylcarbamoyl)butyl]carbamoyl]hexyl]amino]-1-methyl-2-[[2-(1-naphthyloxy)acetyl]amino]-3-oxo-propyl] dihydrogen phosphate, [(3S)-4-[[(3S,5S)-1-cyclohexyl-3-hydroxy-6-methyl-5-[[(3S)-3-methyl-1-oxo-1-(pyridin-2-ylmethylamino)pentan-2-yl]carbamoyl]heptan-2-yl]amino]-3-[(2-naphthalen-1-yloxyacetyl)amino]-4-oxobutan-2-yl] dihydrogen phosphate, Cyclohexanehexanamide, .gamma.-hydroxy-.alpha.-(1-methylethyl)-N-[2-methyl-1-[[(2-pyridinylmethyl)amino]carbonyl]butyl]-.delta.-[[2-[[(1-naphthalenyloxy)acetyl]amino]-1-oxo-3-(phosphonooxy)butyl]amino]-, dipotassium salt, [aS-[N(1R*,2R*),aR*,gR*,dR*(2R*,3S*)]]-, N~2~-[(2S,4S)-6-Cyclohexyl-4-hydroxy-5-[(N-{[(naphthalen-1-yl)oxy]acetyl}-O-phosphono-L-threonyl)amino]-2-(propan-2-yl)hexanoyl]-N-[(pyridin-2-yl)methyl]isoleucinamide
| Molecular Formula | C43H62N5O10P |
|---|---|
| Molecular Weight | 839.42 g/mol |
| LogP | 4.9219 |
| Topological Polar Surface Area | 225.51 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 22 |
| Exact Mass | 839.4234 |
| Heavy Atoms | 59 |
| Complexity | 1866.3771 |
Chemical Identifiers
| CAS Number | 146394-65-2 |
|---|---|
| SMILES | CC[C@H](C)C(C(=O)NCC1=CC=CC=N1)NC(=O)[C@@H](C[C@@H](C(CC2CCCCC2)NC(=O)[C@H](C(C)OP(=O)(O)O)NC(=O)COC3=CC=CC4=CC=CC=C43)O)C(C)C |
Product Overview
Noa-Thr(OPO3K2)-CVA-Ile-Amp (CAS 146394-65-2), with molecular formula C43H62N5O10P and molecular weight 839.42 g/mol. IUPAC: [(3S)-4-[[(3S,5S)-1-cyclohexyl-3-hydroxy-6-methyl-5-[[(3S)-3-methyl-1-oxo-1-(pyridin-2-ylmethylamino)pentan-2-yl]carbamoyl]heptan-2-yl]amino]-3-[(2-naphthalen-1-yloxyacetyl)amino]-4-oxobutan-2-yl] dihydrogen phosphate.
Chemical Property Profile of Noa-Thr(OPO3K2)-CVA-Ile-Amp
Property Insights of Noa-Thr(OPO3K2)-CVA-Ile-Amp
The XLogP value of 4.9219 indicates that Noa-Thr(OPO3K2)-CVA-Ile-Amp is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 225.51 Ų indicates high polarity, suggesting Noa-Thr(OPO3K2)-CVA-Ile-Amp may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Noa-Thr(OPO3K2)-CVA-Ile-Amp has 7 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 Noa-Thr(OPO3K2)-CVA-Ile-Amp?
The CAS number of Noa-Thr(OPO3K2)-CVA-Ile-Amp is 146394-65-2.
What is the molecular formula of Noa-Thr(OPO3K2)-CVA-Ile-Amp?
The molecular formula of Noa-Thr(OPO3K2)-CVA-Ile-Amp is C43H62N5O10P.
What is the molecular weight of Noa-Thr(OPO3K2)-CVA-Ile-Amp?
The molecular weight of Noa-Thr(OPO3K2)-CVA-Ile-Amp is 839.42 g/mol.
Where can I buy Noa-Thr(OPO3K2)-CVA-Ile-Amp?
You can request a quote for Noa-Thr(OPO3K2)-CVA-Ile-Amp directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Noa-Thr(OPO3K2)-CVA-Ile-Amp?
Yes, KEHONG BIO provides custom synthesis services for Noa-Thr(OPO3K2)-CVA-Ile-Amp and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.