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N-(8-Chloro-4,7-dihydroxy-2-oxo-2H-1-benzopyran-3-yl)-4-hydroxy-3-(3-methyl-2-buten-1-yl)benzamide

N-(8-Chloro-4,7-dihydroxy-2-oxo-2H-1-benzopyran-3-yl)-4-hydroxy-3-(3-methyl-2-buten-1-yl)benzamide structure

CAS No:
114515-20-7
Formula:
C21H18ClNO6
Chemical Name:
N-(8-Chloro-4,7-dihydroxy-2-oxo-2H-1-benzopyran-3-yl)-4-hydroxy-3-(3-methyl-2-buten-1-yl)benzamide
Synonyms:
Benzamide,N-(8-chloro-4,7-dihydroxy-2-oxo-2H-1-benzopyran-3-yl)-4-hydroxy-3-(3-methyl-2-buten-1-yl)-;Benzamide,N-(8-chloro-4,7-dihydroxy-2-oxo-2H-1-benzopyran-3-yl)-4-hydroxy-3-(3-methyl-2-butenyl)-;N-(8-Chloro-4,7-dihydroxy-2-oxo-2H-1-benzopyran-3-yl)-4-hydroxy-3-(3-methyl-2-buten-1-yl)benzamide;Chlorobiocic acid;Clorobiocic acid

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Description

Chlorobiocic acid is a hydroxycoumarin.

N-(8-Chloro-4,7-dihydroxy-2-oxo-2H-1-benzopyran-3-yl)-4-hydroxy-3-(3-methyl-2-buten-1-yl)benzamide Basic Attributes

Molecular Weight：

415.826

Exact Mass：

415.82

DSSTox ID：

DTXSID80150754

Characteristics

PSA：

116

XLogP3：

4.2

Density：

1.52g/cm3

Boiling Point：

669.2ºC at 760mmHg

Flash Point：

358.5ºC

Refractive Index：

1.696

Vapor Pressure：

8.01E-19mmHg at 25°C

Drug Information

MeSH：

Compounds that inhibit the activity of DNA TOPOISOMERASE II. Included in this category are a variety of ANTINEOPLASTIC AGENTS which target the eukaryotic form of topoisomerase II and ANTIBACTERIAL AGENTS which target the prokaryotic form of topoisomerase II. (See all compounds classified as Topoisomerase II Inhibitors.)

MeSH Entry Terms：

chlorobiocic acid

Computed Properties

Molecular Weight:415.8
XLogP3:4.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:415.0822650
Monoisotopic Mass:415.0822650
Topological Polar Surface Area:116
Heavy Atom Count:29
Complexity:716
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-(8-Chloro-4,7-dihydroxy-2-oxo-2H-1-benzopyran-3-yl)-4-hydroxy-3-(3-methyl-2-buten-1-yl)benzamide

Description
Basic Attributes
Characteristics
Drug Information
Computed Properties

N-(8-Chloro-4,7-dihydroxy-2-oxo-2H-1-benzopyran-3-yl)-4-hydroxy-3-(3-methyl-2-buten-1-yl)benzamide

SDS

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