17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate
TL;DR: 17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate (CAS 983-28-8) is a chemical compound with molecular formula C22H33N3O3 and molecular weight 387.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S,8R,9S,10R,13S,14S)-17-(carbamoylhydrazinylidene)-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate
Also Known As: 17-(Carbamoylhydrazono)androst-5-en-3beta-yl acetate, 17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate, 17-(2-Carbamoylhydrazinylidene)androst-5-en-3beta-yl acetate, [(3S,8R,9S,10R,13S,14S,17E)-17-(carbamoylhydrazinylidene)-10
| Molecular Formula | C22H33N3O3 |
|---|---|
| Molecular Weight | 387.25 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 93.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 387.2522 |
| Heavy Atoms | 28 |
| Complexity | 745.0 |
Chemical Identifiers
| CAS Number | 983-28-8 |
|---|---|
| SMILES | CC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CCC4=NNC(=O)N)C)C |
| InChIKey | CDZFBBLHHNZLCF-CSOYKPOESA-N |
Product Overview
17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate (CAS 983-28-8), with molecular formula C22H33N3O3 and molecular weight 387.25 g/mol. IUPAC: [(3S,8R,9S,10R,13S,14S)-17-(carbamoylhydrazinylidene)-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate.
Chemical Property Profile of 17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate
Property Insights of 17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate
The XLogP value of 3.0 indicates that 17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate. Following Lipinski's Rule of Five, 17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate has 2 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 17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate?
The CAS number of 17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate is 983-28-8.
What is the molecular formula of 17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate?
The molecular formula of 17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate is C22H33N3O3.
What is the molecular weight of 17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate?
The molecular weight of 17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate is 387.25 g/mol.
Where can I buy 17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate?
You can request a quote for 17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 17-(Carbamoylhydrazono)androst-5-en-3I(2)-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.