12-phenyl-12-sulfanylidene-11H-phosphindolo[2,3-a]carbazole

C24H16NPS — CID 144920218

IUPAC12-phenyl-12-sulfanylidene-11H-phosphindolo[2,3-a]carbazole
SMILESS=P1(c2ccccc2)c2ccccc2-c2ccc3c([nH]c4ccccc43)c21
InChIInChI=1S/C24H16NPS/c27-26(16-8-2-1-3-9-16)22-13-7-5-11-18(22)20-15-14-19-17-10-4-6-12-21(17)25-23(19)24(20)26/h1-15,25H
InChIKeyZSMXZLSGVGSIDH-UHFFFAOYSA-N
MW381.44 g/mol
LogP5.06
Rot. Bonds1

About 12-phenyl-12-sulfanylidene-11H-phosphindolo[2,3-a]carbazole

12-phenyl-12-sulfanylidene-11H-phosphindolo[2,3-a]carbazole (PubChem CID 144920218) has the molecular formula C24H16NPS and a molecular weight of 381.44 g/mol. Its IUPAC name is 12-phenyl-12-sulfanylidene-11H-phosphindolo[2,3-a]carbazole.

Molecular Properties

Compound Name12-phenyl-12-sulfanylidene-11H-phosphindolo[2,3-a]carbazole
PubChem CID144920218
Molecular FormulaC24H16NPS
Molecular Weight381.44 g/mol
Exact Mass381.07
IUPAC Name12-phenyl-12-sulfanylidene-11H-phosphindolo[2,3-a]carbazole
SMILESS=P1(c2ccccc2)c2ccccc2-c2ccc3c([nH]c4ccccc43)c21
InChIInChI=1S/C24H16NPS/c27-26(16-8-2-1-3-9-16)22-13-7-5-11-18(22)20-15-14-19-17-10-4-6-12-21(17)25-23(19)24(20)26/h1-15,25H
InChIKeyZSMXZLSGVGSIDH-UHFFFAOYSA-N
XLogP5.06
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.44
LogP ≤ 55.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

1-[2-(9H-carbazol-1-yl)phenyl]-9H-carbazole
CID 66618059
2-phenyl-9H-carbazol-1-ol
CID 118682381
2-phenyl-1-[2-(2-phenylphenyl)phenyl]-9H-carbazole
CID 175810987
1-[4-[4-[4-[4-(9H-carbazol-1-yl)phenyl]phenyl]phenyl]phenyl]-9H-carbazole
CID 175958773
11,12-dihydroindolo[2,3-a]carbazol-11-ium
CID 145186761
spiro[11H-indeno[2,1-a]carbazole-12,9'-fluorene]
CID 118343947
1-fluoranthen-3-yl-9H-carbazole
CID 142752993
(2-phenyl-9H-carbazol-1-yl)boronic acid
CID 90240271
1-(3,4-diphenylphenyl)-9H-carbazole
CID 141489388
2-(2-methylphenyl)-N-phenyl-9H-carbazol-1-amine
CID 146574333
9H-carbazole
CID 66668984
16-azahexacyclo[12.11.0.02,11.05,10.015,23.017,22]pentacosa-1(14),2(11),3,5,7,9,12,15(23),17,19,21,24-dodecaene
CID 86153881

Frequently Asked Questions

What is the IUPAC name of 12-phenyl-12-sulfanylidene-11H-phosphindolo[2,3-a]carbazole?
The IUPAC name of 12-phenyl-12-sulfanylidene-11H-phosphindolo[2,3-a]carbazole (CID 144920218) is 12-phenyl-12-sulfanylidene-11H-phosphindolo[2,3-a]carbazole.
What is the SMILES notation for 12-phenyl-12-sulfanylidene-11H-phosphindolo[2,3-a]carbazole?
The canonical SMILES for 12-phenyl-12-sulfanylidene-11H-phosphindolo[2,3-a]carbazole is S=P1(c2ccccc2)c2ccccc2-c2ccc3c([nH]c4ccccc43)c21.
What is the InChIKey of 12-phenyl-12-sulfanylidene-11H-phosphindolo[2,3-a]carbazole?
The InChIKey is ZSMXZLSGVGSIDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16NPS/c27-26(16-8-2-1-3-9-16)22-13-7-5-11-18(22)20-15-14-19-17-10-4-6-12-21(17)25-23(19)24(20)26/h1-15,25H.
What are the key properties of 12-phenyl-12-sulfanylidene-11H-phosphindolo[2,3-a]carbazole?
12-phenyl-12-sulfanylidene-11H-phosphindolo[2,3-a]carbazole has a molecular weight of 381.44 g/mol, XLogP of 5.06, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 12-phenyl-12-sulfanylidene-11H-phosphindolo[2,3-a]carbazole is sourced from PubChem (CID 144920218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).