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N-[(7S)-5,6,7,9-Tetrahydro-1,2,3-trimethoxy-10-(methylthio)-9-oxobenzo[a]heptalen-7-yl]formamide

N-[(7S)-5,6,7,9-Tetrahydro-1,2,3-trimethoxy-10-(methylthio)-9-oxobenzo[a]heptalen-7-yl]formamide structure

CAS No:
2731-23-9
Formula:
C21H23NO5S
Chemical Name:
N-[(7S)-5,6,7,9-Tetrahydro-1,2,3-trimethoxy-10-(methylthio)-9-oxobenzo[a]heptalen-7-yl]formamide
Synonyms:
Formamide,N-[(7S)-5,6,7,9-tetrahydro-1,2,3-trimethoxy-10-(methylthio)-9-oxobenzo[a]heptalen-7-yl]-;Colchicine,N-deacetyl-N-formyl-10-thio-;Formamide,N-[5,6,7,9-tetrahydro-1,2,3-trimethoxy-10-(methylthio)-9-oxobenzo[a]heptalen-7-yl]-,(S)-;Benzo[a]heptalene,formamide deriv.;N-[(7S)-5,6,7,9-Tetrahydro-1,2,3-trimethoxy-10-(methylthio)-9-oxobenzo[a]heptalen-7-yl]formamide;N-Deacetyl-N-formylthiocolchicine;NSC 373031

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N-[(7S)-5,6,7,9-Tetrahydro-1,2,3-trimethoxy-10-(methylthio)-9-oxobenzo[a]heptalen-7-yl]formamide Basic Attributes

Molecular Weight：

401.5 g/mol

Exact Mass：

401.48

NSC Number：

373031

Characteristics

PSA：

99.2 Å²

Melting Point：

259 °C @ Solvent: Ethyl acetate

Safety Information

GHS Classification：

|Danger|H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral]|P260, P264, P270, P271, P284, P301+P310, P304+P340, P310, P320, P321, P330, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.|P201, P202, P260, P264, P270, P271, P280, P281, P284, P301+P310, P304+P340, P305+P351+P338, P308+P313, P310, P320, P321, P330, P403+P233, P405, and P501

Computed Properties

Molecular Weight:401.5
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:401.12969401
Monoisotopic Mass:401.12969401
Topological Polar Surface Area:99.2
Heavy Atom Count:28
Complexity:701
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: 1-chlorobutane; d glucopyranose; ipa sds; borane; aluminum phosphate formula; tetrakis hydroxymethyl phosphonium sulfate

Guide of N-[(7S)-5,6,7,9-Tetrahydro-1,2,3-trimethoxy-10-(methylthio)-9-oxobenzo[a]heptalen-7-yl]formamide

Basic Attributes
Characteristics
Safety Information
Computed Properties

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