16alpha-(Methylthio)progesterone
TL;DR: 16alpha-(Methylthio)progesterone (CAS 36237-86-2) is a chemical compound with molecular formula C22H32O2S and molecular weight 360.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9S,10R,13S,14S,16R,17S)-17-acetyl-10,13-dimethyl-16-methylsulfanyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Also Known As: tirilazad of tirilazad, 16A- PROGESTERONE, 16A-(METHYLTHIO)PROGESTERONE, 16alpha-(Methylthio)progesterone, 16.alpha.-(Methylthio)progesterone
| Molecular Formula | C22H32O2S |
|---|---|
| Molecular Weight | 360.21 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 59.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 360.2123 |
| Heavy Atoms | 25 |
| Complexity | 638.0 |
Chemical Identifiers
| CAS Number | 36237-86-2 |
|---|---|
| SMILES | CC(=O)[C@H]1[C@@H](C[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C)SC |
| InChIKey | MTOGCFGVYHTEAT-QQYXXPEKSA-N |
Product Overview
16alpha-(Methylthio)progesterone (CAS 36237-86-2), with molecular formula C22H32O2S and molecular weight 360.21 g/mol. IUPAC: (8S,9S,10R,13S,14S,16R,17S)-17-acetyl-10,13-dimethyl-16-methylsulfanyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 16alpha-(Methylthio)progesterone
Property Insights of 16alpha-(Methylthio)progesterone
The XLogP value of 4.0 indicates that 16alpha-(Methylthio)progesterone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.4 Ų, 16alpha-(Methylthio)progesterone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 16alpha-(Methylthio)progesterone has 0 hydrogen bond donor(s) and 3 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 16alpha-(Methylthio)progesterone?
The CAS number of 16alpha-(Methylthio)progesterone is 36237-86-2.
What is the molecular formula of 16alpha-(Methylthio)progesterone?
The molecular formula of 16alpha-(Methylthio)progesterone is C22H32O2S.
What is the molecular weight of 16alpha-(Methylthio)progesterone?
The molecular weight of 16alpha-(Methylthio)progesterone is 360.21 g/mol.
Where can I buy 16alpha-(Methylthio)progesterone?
You can request a quote for 16alpha-(Methylthio)progesterone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 16alpha-(Methylthio)progesterone?
Yes, KEHONG BIO provides custom synthesis services for 16alpha-(Methylthio)progesterone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.