N-(Butoxycarbonyl)deacetylthiocolchicine

butyl N-(1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)carbamate

CAS: 97043-04-4

Molecular Formula	`C25H31NO6S`
Molecular Weight	473.6 g/mol
LogP	3.4
Topological Polar Surface Area	108.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	9
Exact Mass	473.1872
Heavy Atoms	33
Complexity	807.0

Chemical Identifiers

CAS Number	97043-04-4
SMILES	`CCCCOC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)OC`
InChIKey	`BJAJYTAHDSJTTM-UHFFFAOYSA-N`

📖 Product Overview

N-(Butoxycarbonyl)deacetylthiocolchicine (CAS: 97043-04-4) is a chemical compound with molecular formula C25H31NO6S and molecular weight 473.6 g/mol. Its IUPAC systematic name is butyl N-(1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)carbamate. LogP 3.4 Topological Polar Surface Area 108.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 7 Rotatable Bonds 9 Exact Mass 473.1872 Heavy Atoms 33 Complexity 807.0 InChI Key: BJAJYTAHDSJTTM-UHFFFAOYSA-N. SMILES: CCCCOC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)OC.

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