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2-[3-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]indol-1-yl]acetic acid;hydrate

2-[3-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]indol-1-yl]acetic acid;hydrate structure

CAS No:
653599-32-7
Formula:
C18H13F3N2O3S
Chemical Name:
2-[3-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]indol-1-yl]acetic acid;hydrate
Synonyms:
3-((4,5,7-trifluorobenzothiazol-2-yl)methyl)indole-N-acetic acid;lidorestat;UNII-9Z74BD3QPP;9Z74BD3QPP;Lidorestat [USAN:INN];653599-32-7;Lidorestat (USAN);Lidorestat monohydrate;SCHEMBL6103908;DTXSID10215688;D03803;1H-Indole-1-acetic acid, 3-((4,5,7-trifluoro-2-benzothiazolyl)methyl)-, monohydrate;3-((4,5,7-Triflurobenzothiazol-2-yl)methyl)-1H-indol-1-yl)acetic acid, monohydrate

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2-[3-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]indol-1-yl]acetic acid;hydrate Basic Attributes

Molecular Weight：

394.4 g/mol

Exact Mass：

394.05989794 g/mol

UNII：

9Z74BD3QPP

DSSTox ID：

DTXSID10215688

Characteristics

PSA：

84.4 Å²

Drug Information

MeSH Entry Terms：

3-((4,5,7-trifluorobenzothiazol-2-yl)methyl)indole-N-acetic acid

Computed Properties

Molecular Weight:394.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:394.05989794
Monoisotopic Mass:394.05989794
Topological Polar Surface Area:84.4
Heavy Atom Count:27
Complexity:543
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 2-[3-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]indol-1-yl]acetic acid;hydrate

Basic Attributes
Characteristics
Drug Information
Computed Properties

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