General Information of the Compound
| Compound ID |
CP0093733
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| Compound Name |
1-[5-(2,3-dichlorophenyl)sulfanyl-4-nitrothiophen-2-yl]ethanone
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| Synonyms |
1-(5-((2,3-Dichlorophenyl)thio)-4-nitrothiophen-2-yl)ethanone
1-(5-(2,3-dichlorophenylthio)-4-nitrothiophen-2-yl)ethanone
1-[5-(2,3-Dichloro-phenylsulfanyl)-4-nitro-thiophen-2-yl]-ethanone
1-[5-(2,3-dichlorophenyl)sulfanyl-4-nitro-2-thienyl]ethanone
1-[5-(2,3-dichlorophenyl)sulfanyl-4-nitrothiophen-2-yl]ethanone
1-[5-(2,3-dichlorophenylsulfanyl)-4-nitro-2-thienyl]ethanone
1-[5-[(2,3-Dichlorophenyl)thio]-4-n?itro-2-thienyl]ethanone
1-[5-[(2,3-Dichlorophenyl)thio]-4-nitro-2-thienyl]ethanone
1-{5-[(2,3-Dichlorophenyl)sulfanyl]-4-nitrothiophen-2-yl}ethan-1-one
882257-11-6
AC-32692
AK270202
AKOS024458314
BCP07750
BDBM50393437
BS-17872
C12H7Cl2NO3S2
CCG-240421
CHEMBL2159495
CS-1445
Cyto5D7
DA-40897
DTXSID90384841
EX-A2120
FT-0714931
HMS3653E09
HMS3743M19
HY-15667
J3.502.625H
MCULE-6661883192
MFCD00123202
P 005091
P 5091
P-005091
P-05091
P-5091
P005091
P005091(P5091)
P5091
P5091 (P005091)
QC-8200
SB19505
SCHEMBL2681288
SW219710-1
Y1893
ZINC125366
s7132
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| Structure |
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| Formula |
C12H7Cl2NO3S2
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| Molecular Weight |
348.232
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| Canonical SMILES |
CC(=O)c1cc(c(Sc2cccc(Cl)c2Cl)s1)[N+]([O-])=O
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| InChI |
InChI=1S/C12H7Cl2NO3S2/c1-6(16)10-5-8(15(17)18)12(20-10)19-9-4-2-3-7(13)11(9)14/h2-5H,1H3
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| InChIKey |
LKZLGMAAKNEGCH-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Clinical Information about the Compound