Chemical ID: 4674100

c1cc([nH]c1)c2c3c(c(s2)c4ccc[nH]4)OCCO3
Chemical ID:
4674100
Name [?]:
2-[7-(1H-pyrrol-2-yl)-2,5-dioxa-8-thiabicyclo[4.3.0]nona-6,9-dien-9-yl]-1H-pyrrole
SMILES [?]:
c1cc([nH]c1)c2c3c(c(s2)c4ccc[nH]4)OCCO3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H12N2O2S
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.03829
Area:437.739
Solvation:-2.90518
Coulombic:-38.6999
Bond Count [?]
All:22
Single:16
Double:6
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:272.323
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.4
LogP (Chemaxon):1.44

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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