Norethisterone acetate 3-cyclopentylpropionate
TL;DR: Norethisterone acetate 3-cyclopentylpropionate (CAS 99112-29-5) is a chemical compound with molecular formula C30H42O4 and molecular weight 466.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,5R,8R,9S,13S,14S,17R)-17-acetyloxy-17-ethynyl-13-methyl-4,5,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-1-yl] 3-cyclopentylpropanoate
Also Known As: Neacpp, KST-1A0234, Norethisterone acetate 3-cyclopentylpropionate, (1, A,5
| Molecular Formula | C30H42O4 |
|---|---|
| Molecular Weight | 466.31 g/mol |
| LogP | 7.1 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 466.30832 |
| Heavy Atoms | 34 |
| Complexity | 875.0 |
Chemical Identifiers
| CAS Number | 99112-29-5 |
|---|---|
| SMILES | CC(=O)O[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4C3[C@H](C=CC4)OC(=O)CCC5CCCC5)C)C#C |
| InChIKey | UKRBBAYWDWAZQF-RYSPWXMHSA-N |
Product Overview
Norethisterone acetate 3-cyclopentylpropionate (CAS 99112-29-5), with molecular formula C30H42O4 and molecular weight 466.31 g/mol. IUPAC: [(1S,5R,8R,9S,13S,14S,17R)-17-acetyloxy-17-ethynyl-13-methyl-4,5,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-1-yl] 3-cyclopentylpropanoate.
Chemical Property Profile of Norethisterone acetate 3-cyclopentylpropionate
Property Insights of Norethisterone acetate 3-cyclopentylpropionate
The XLogP value of 7.1 indicates that Norethisterone acetate 3-cyclopentylpropionate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Norethisterone acetate 3-cyclopentylpropionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Norethisterone acetate 3-cyclopentylpropionate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Norethisterone acetate 3-cyclopentylpropionate?
The CAS number of Norethisterone acetate 3-cyclopentylpropionate is 99112-29-5.
What is the molecular formula of Norethisterone acetate 3-cyclopentylpropionate?
The molecular formula of Norethisterone acetate 3-cyclopentylpropionate is C30H42O4.
What is the molecular weight of Norethisterone acetate 3-cyclopentylpropionate?
The molecular weight of Norethisterone acetate 3-cyclopentylpropionate is 466.31 g/mol.
Where can I buy Norethisterone acetate 3-cyclopentylpropionate?
You can request a quote for Norethisterone acetate 3-cyclopentylpropionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Norethisterone acetate 3-cyclopentylpropionate?
Yes, KEHONG BIO provides custom synthesis services for Norethisterone acetate 3-cyclopentylpropionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.