Chemical Properties of Brotizolam (CAS 57801-81-7)

Brotizolam

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InChI
InChI=1S/C15H10BrClN4S/c1-8-19-20-13-7-18-14(9-4-2-3-5-11(9)17)10-6-12(16)22-15(10)21(8)13/h2-6H,7H2,1H3
InChI Key
UMSGKTJDUHERQW-UHFFFAOYSA-N
Formula
C15H10BrClN4S
SMILES
Cc1nnc2n1-c1sc(Br)cc1C(c1ccccc1Cl)=NC2
Molecular Weight1
393.69
CAS
57801-81-7
Other Names
  • 6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine, 2-bromo-4-(2-chlorophenyl)-9-methyl-
  • 2-Bromo-4-(2-chlorophenyl)-9-methyl-6H-thieno(3,2-f)(1,2,4)triazolo(4,3-a)(1,4)diazepine
  • Lendormin
  • WE 941
  • WE 941-BS
  • 2-Bromo-4-(o-chlorophenyl)-9-methyl-6H-thieno[3,2-f]-s-triazolo[4,3-a]-[1,4]diazepine
  • Lendorm
  • Mederantil
  • Sintonal
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Physical Properties

Property Value Unit Source
ω 0.6650 Relay (... Calculated Property
ΔfG° 440.19 kJ/mol Relay (... Calculated Property ⚠️
ΔfH°gas 498.55 kJ/mol Relay (... Calculated Property
ΔvapH° 123.25 kJ/mol Relay (... Calculated Property
IE 7.89 eV Relay (... Calculated Property
log10WS -4.72 Relay (... Calculated Property
logPoct/wat 4.404 Crippen Calculated Property
McVol 230.380 ml/mol McGowan Calculated Property
Pc 2966.10 kPa Relay (... Calculated Property ⚠️
Inp 3090.00 NIST
Tboil 716.81 K Relay (... Calculated Property
Tc 1089.50 K Relay (... Calculated Property
Tfus 534.33 K Relay (... Calculated Property
Vc 0.831 m3/kmol Relay (... Calculated Property

Similar Compounds

Brotizolam, M (hydroxy-), acetylated. etizolam. Nalmefene, bis(trifluoroacetate). Ergotaman-3',6',18-trione, 12'-hydroxy-2'-(1-methylethyl)-5'-(2-methylpropyl)-, (5'«alpha»)-. AJMALINE, M(DIHYDRO-), AC. Dihydroergokryptine. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Deserpidine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine. Ergocristine.

Find more compounds similar to Brotizolam.

Sources

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