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Terutroban

Terutroban structure

Terutroban 

structure
  • CAS No:

    165538-40-9

  • Formula:

    C20H22ClNO4S

  • Chemical Name:

    Terutroban

  • Synonyms:

    1-Naphthalenepropanoic acid,6-[[(4-chlorophenyl)sulfonyl]amino]-5,6,7,8-tetrahydro-2-methyl-,(6R)-;1-Naphthalenepropanoic acid,6-[[(4-chlorophenyl)sulfonyl]amino]-5,6,7,8-tetrahydro-2-methyl-,(R)-;(6R)-6-[[(4-Chlorophenyl)sulfonyl]amino]-5,6,7,8-tetrahydro-2-methyl-1-naphthalenepropanoic acid;Terutroban;Triplion;(R)-3-(6-(4-Chlorophenylsulfonamido)-2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)propanoic acid

Terutroban Basic Attributes

407.91100

407.91

605-410-9

A6WX9391D8

Characteristics

91.85000

4.97310

1.389g/cm3

591.818ºC at 760 mmHg

311.721ºC

1.637

0mmHg at 25°C

Safety Information

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

3-((6-amino-(4-chlorobenzenesulfonyl)-2-methyl-5,6,7,8-tetrahydronapht)-1-yl)propionic acid

Computed Properties

Molecular Weight:407.9
XLogP3:4.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:407.0958071
Monoisotopic Mass:407.0958071
Topological Polar Surface Area:91.8
Heavy Atom Count:27
Complexity:612
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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