9-bromo-2-(4-methylbenzene-1-sulfonyl)-4-nitro-2,11-dihydro[1]benzoxepino[4,3,2-cd]indole

Chemical Structure Depiction of
9-bromo-2-(4-methylbenzene-1-sulfonyl)-4-nitro-2,11-dihydro[1]benzoxepino[4,3,2-cd]indole
Available: 32 mg
Amount:
mg
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Compound characteristics

Compound ID: 8014-9216
Compound Name: 9-bromo-2-(4-methylbenzene-1-sulfonyl)-4-nitro-2,11-dihydro[1]benzoxepino[4,3,2-cd]indole
Molecular Weight: 499.34
Molecular Formula: C22 H15 Br N2 O5 S
Smiles: Cc1ccc(cc1)S(n1cc2Cc3cc(ccc3Oc3cc(cc1c23)[N+]([O-])=O)[Br])(=O)=O
Stereo: ACHIRAL
logP: 6.044
logD: 6.044
logSw: -5.7737
Hydrogen bond acceptors count: 9
Polar surface area: 69.757
InChI Key: ZNSXZHZCCBFGNS-UHFFFAOYSA-N
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