Norgestimate
TL;DR: Norgestimate (CAS 107382-51-4) is a chemical compound with molecular formula C23H31NO3 and molecular weight 369.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3E,8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-3-hydroxyimino-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate
Also Known As: NORGESTIMATE, Dexnorgestrel acetime, Norgestimato, Norgestimatum, Ortho-Prefest
| Molecular Formula | C23H31NO3 |
|---|---|
| Molecular Weight | 369.23 g/mol |
| LogP | 4.7145 |
| Topological Polar Surface Area | 58.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 369.2304 |
| Heavy Atoms | 27 |
| Complexity | 732.3957 |
Chemical Identifiers
| CAS Number | 107382-51-4 |
|---|---|
| SMILES | CC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)OC(=O)C)CCC4=C/C(=N/O)/CC[C@H]34 |
Product Overview
Norgestimate (CAS 107382-51-4), with molecular formula C23H31NO3 and molecular weight 369.23 g/mol. IUPAC: [(3E,8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-3-hydroxyimino-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate.
Chemical Property Profile of Norgestimate
Property Insights of Norgestimate
The XLogP value of 4.7145 indicates that Norgestimate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.89 Ų, Norgestimate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Norgestimate has 1 hydrogen bond donor(s) and 4 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 Norgestimate?
The CAS number of Norgestimate is 107382-51-4.
What is the molecular formula of Norgestimate?
The molecular formula of Norgestimate is C23H31NO3.
What is the molecular weight of Norgestimate?
The molecular weight of Norgestimate is 369.23 g/mol.
Where can I buy Norgestimate?
You can request a quote for Norgestimate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Norgestimate?
Yes, KEHONG BIO provides custom synthesis services for Norgestimate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.