Desocriptine
TL;DR: Desocriptine (CAS 66759-48-6) is a chemical compound with molecular formula C32H45N5O4 and molecular weight 563.34717 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6aS,9R,10aR)-N-[(1S,2S,4R,7S)-7-[(2S)-butan-2-yl]-2-hydroxy-5-oxo-4-propan-2-yl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecan-4-yl]-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
Also Known As: Desocriptine, Desocriptinum, Desocriptine [INN], (6As,9R,10aR)-N-[(1S,2S,4R,7S)-7-[(2S)-butan-2-yl]-2-hydroxy-5-oxo-4-propan-2-yl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecan-4-yl]-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide, N-[(2R,5S,10aS,10bS)-5-[(2S)-Butan-2-yl]-10b-hydroxy-3-oxo-2-(propan-2-yl)octahydro-8H-[1,3]oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl]-6-methyl-5alpha-ergoline-8beta-carboximidic acid
Technical Specifications
| Molecular Formula | C32H45N5O4 |
| Molecular Weight | 563.34717 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 563.34717 Da |
| Heavy Atoms | 41 |
| Complexity | 1060.0 |
| SMILES | CC[C@H](C)[C@H]1CN2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@@H]4C[C@H]5[C@H](CC6=CNC7=CC=CC5=C67)N(C4)C)O |
| InChIKey | OPAVODIYXVLOOM-XAOZLXPPSA-N |
Chemical Property Profile of Desocriptine
Property Insights of Desocriptine
The XLogP value of 3.6 indicates that Desocriptine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Desocriptine. Following Lipinski's Rule of Five, Desocriptine has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Desocriptine?
The CAS number of Desocriptine is 66759-48-6.
What is the molecular formula of Desocriptine?
The molecular formula of Desocriptine is C32H45N5O4.
What is the molecular weight of Desocriptine?
The molecular weight of Desocriptine is 563.34717 g/mol.
Where can I buy Desocriptine?
You can request a quote for Desocriptine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Desocriptine?
Yes, CoreyChem provides custom synthesis services for Desocriptine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.