(3β,20S)-孕甾-5-烯-3,20-二胺
TL;DR: (3β,20S)-孕甾-5-烯-3,20-二胺 (CAS 3614-57-1) is a chemical compound with molecular formula C21H36N2 and molecular weight 316.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3β,20S)-孕甾-5-烯-3,20-二胺
(3S,8S,9S,10R,13S,14S,17S)-17-[(1S)-1-aminoethyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-amine
Also Known As: Irehdiamine A, Irehidamine A, Irehdiamine, Irehdiamin-A, Pregn-5-ene-3,20-diamine
| Molecular Formula | C21H36N2 |
|---|---|
| Molecular Weight | 316.29 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 316.28784 |
| Heavy Atoms | 23 |
| Complexity | 512.0 |
Chemical Identifiers
| CAS Number | 3614-57-1 |
|---|---|
| SMILES | C[C@@H]([C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)N)C)C)N |
| InChIKey | XDELLWIDOQOKHV-YZXCLFAISA-N |
Product Overview
(3β,20S)-孕甾-5-烯-3,20-二胺 (CAS 3614-57-1), with molecular formula C21H36N2 and molecular weight 316.29 g/mol. IUPAC: (3S,8S,9S,10R,13S,14S,17S)-17-[(1S)-1-aminoethyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-amine.
Chemical Property Profile of (3β,20S)-孕甾-5-烯-3,20-二胺
Property Insights of (3β,20S)-孕甾-5-烯-3,20-二胺
The XLogP value of 4.0 indicates that (3β,20S)-孕甾-5-烯-3,20-二胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.0 Ų, (3β,20S)-孕甾-5-烯-3,20-二胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3β,20S)-孕甾-5-烯-3,20-二胺 has 2 hydrogen bond donor(s) and 2 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 (3β,20S)-孕甾-5-烯-3,20-二胺?
The CAS number of (3β,20S)-孕甾-5-烯-3,20-二胺 is 3614-57-1.
What is the molecular formula of (3β,20S)-孕甾-5-烯-3,20-二胺?
The molecular formula of (3β,20S)-孕甾-5-烯-3,20-二胺 is C21H36N2.
What is the molecular weight of (3β,20S)-孕甾-5-烯-3,20-二胺?
The molecular weight of (3β,20S)-孕甾-5-烯-3,20-二胺 is 316.29 g/mol.
Where can I buy (3β,20S)-孕甾-5-烯-3,20-二胺?
You can request a quote for (3β,20S)-孕甾-5-烯-3,20-二胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3β,20S)-孕甾-5-烯-3,20-二胺?
Yes, KEHONG BIO provides custom synthesis services for (3β,20S)-孕甾-5-烯-3,20-二胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.