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(7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one structure
Fine Chemical

(7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one

TL;DR: (7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one (CAS 1212494-19-3) is a chemical compound with molecular formula C24H32N2O6 and molecular weight 444.22604 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one

Also Known As: (7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one

CAS Number
1212494-19-3
Molecular Formula
C24H32N2O6
Molecular Weight
444.22604 g/mol
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Technical Specifications

Molecular FormulaC24H32N2O6
Molecular Weight444.22604 g/mol
XLogP1.4
Topological Polar Surface Area (TPSA)100.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors8
Rotatable Bonds9
Exact Mass444.22604 Da
Heavy Atoms32
Complexity749.0
SMILESCN(CCO)[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)NCCO)OC)OC)OC
InChIKeyPIFWVYULEKIYFF-IBGZPJMESA-N

Chemical Property Profile of (7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one

XLogP
1.4
TPSA (Topological Polar Surface Area)
100.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
8
Rotatable Bonds
9
Heavy Atoms
32
Complexity
749.0
Exact Mass
444.22604
Monoisotopic Mass
444.22604
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of (7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one

The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one. Following Lipinski's Rule of Five, (7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of (7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one?

The CAS number of (7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one is 1212494-19-3.

What is the molecular formula of (7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one?

The molecular formula of (7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one is C24H32N2O6.

What is the molecular weight of (7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one?

The molecular weight of (7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one is 444.22604 g/mol.

Where can I buy (7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one?

You can request a quote for (7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one?

Yes, CoreyChem provides custom synthesis services for (7S)-10-(2-hydroxyethylamino)-7-[2-hydroxyethyl(methyl)amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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