Phenyl 1-thio-b-D-galactopyranoside
TL;DR: Phenyl 1-thio-b-D-galactopyranoside (CAS 16758-47-7) is a chemical compound with molecular formula C28H37NO4 and molecular weight 451.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,6R,14R,15S,19R)-19-(1-cyclohexyl-1-hydroxyethyl)-15-methoxy-5-methyl-13-oxa-5-azahexacyclo[13.2.2.12,8.01,6.02,14.012,20]icosa-8(20),9,11,16-tetraen-11-ol
Also Known As: Phenyl 1-thio-b-D-galactopyranoside, 6,14-Endoetheno-7-(2-cyclohexyl-2-hydroxy-2-ethyl)-tetrahydro-oripavine, Morphinan-3-ol, 7-(2-cyclohexyl-2-hydroxy-2-ethyl)-6,14-endoetheno-4,5-alpha-epoxy-6-methoxy-17-methyl-, 7-(1-Cyclohexyl-1-hydroxyethyl)-6-methoxy-17-methyl-4,5-epoxy-6,14-ethenomorphinan-3-ol, (2S,6R,14R,15S,19R)-19-(1-cyclohexyl-1-hydroxyethyl)-15-methoxy-5-methyl-13-oxa-5-azahexacyclo[13.2.2.12,8.01,6.02,14.012,20]icosa-8(20),9,11,16-tetraen-11-ol
| Molecular Formula | C28H37NO4 |
|---|---|
| Molecular Weight | 451.27 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 62.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 451.27225 |
| Heavy Atoms | 33 |
| Complexity | 857.0 |
Chemical Identifiers
| CAS Number | 16758-47-7 |
|---|---|
| SMILES | CC([C@H]1CC23C=C[C@]1([C@H]4[C@@]25CCN([C@@H]3CC6=C5C(=C(C=C6)O)O4)C)OC)(C7CCCCC7)O |
| InChIKey | SHOLSAOUSMCLOR-HGRVVPQMSA-N |
Product Overview
Phenyl 1-thio-b-D-galactopyranoside (CAS 16758-47-7), with molecular formula C28H37NO4 and molecular weight 451.27 g/mol. IUPAC: (2S,6R,14R,15S,19R)-19-(1-cyclohexyl-1-hydroxyethyl)-15-methoxy-5-methyl-13-oxa-5-azahexacyclo[13.2.2.12,8.01,6.02,14.012,20]icosa-8(20),9,11,16-tetraen-11-ol.
Chemical Property Profile of Phenyl 1-thio-b-D-galactopyranoside
Property Insights of Phenyl 1-thio-b-D-galactopyranoside
The XLogP value of 4.2 indicates that Phenyl 1-thio-b-D-galactopyranoside is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenyl 1-thio-b-D-galactopyranoside. Following Lipinski's Rule of Five, Phenyl 1-thio-b-D-galactopyranoside has 2 hydrogen bond donor(s) and 5 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 Phenyl 1-thio-b-D-galactopyranoside?
The CAS number of Phenyl 1-thio-b-D-galactopyranoside is 16758-47-7.
What is the molecular formula of Phenyl 1-thio-b-D-galactopyranoside?
The molecular formula of Phenyl 1-thio-b-D-galactopyranoside is C28H37NO4.
What is the molecular weight of Phenyl 1-thio-b-D-galactopyranoside?
The molecular weight of Phenyl 1-thio-b-D-galactopyranoside is 451.27 g/mol.
Where can I buy Phenyl 1-thio-b-D-galactopyranoside?
You can request a quote for Phenyl 1-thio-b-D-galactopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl 1-thio-b-D-galactopyranoside?
Yes, KEHONG BIO provides custom synthesis services for Phenyl 1-thio-b-D-galactopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.