2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate
TL;DR: 2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate (CAS 72050-78-3) is a chemical compound with molecular formula C32H37NO5S and molecular weight 547.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-(2-methyl-3,4-diphenyl-3-propanoyloxybutyl)azanium;naphthalene-2-sulfonate
Also Known As: 2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate, 2-Naphthalenesulfonic acid, compd. with 3-(dimethylamino)-2-methyl-1-phenyl-1-(phenylmethyl)propyl propanoate (1:1), 2-Naphthalenesulfonic acid, compd. with 4-(dimethylamino)-3-methyl-1,2-diphenyl-2-butanol propionate (1:1), Benzeneethanol, alpha-(2-(dimethylamino)-1-methylethyl)-alpha-phenyl-, propanoate (ester), 2-naphthalenesulfonate, 2-BUTANOL, 4-(DIMETHYLAMINO)-3-METHYL-1,2-DIPHENYL-, PROPIONATE (ester), NAPSYLA
| Molecular Formula | C32H37NO5S |
|---|---|
| Molecular Weight | 547.24 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 547.23926 |
| Heavy Atoms | 39 |
| Complexity | 674.0 |
Chemical Identifiers
| CAS Number | 72050-78-3 |
|---|---|
| SMILES | CCC(=O)OC(CC1=CC=CC=C1)(C2=CC=CC=C2)C(C)C[NH+](C)C.C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)[O-] |
| InChIKey | VZPXFHVJUUSVLH-UHFFFAOYSA-N |
Product Overview
2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate (CAS 72050-78-3), with molecular formula C32H37NO5S and molecular weight 547.24 g/mol. IUPAC: dimethyl-(2-methyl-3,4-diphenyl-3-propanoyloxybutyl)azanium;naphthalene-2-sulfonate.
Chemical Property Profile of 2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate
Property Insights of 2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate
The XLogP value of 4.6 indicates that 2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate. Following Lipinski's Rule of Five, 2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate?
The CAS number of 2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate is 72050-78-3.
What is the molecular formula of 2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate?
The molecular formula of 2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate is C32H37NO5S.
What is the molecular weight of 2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate?
The molecular weight of 2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate is 547.24 g/mol.
Where can I buy 2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate?
You can request a quote for 2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate?
Yes, KEHONG BIO provides custom synthesis services for 2-Butanol, 4-(dimethylamino)-3-methyl-1,2-diphenyl-, propionate (ester), napsylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.