15-carbazol-9-yl-4-methyl-3,8-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7(11),9,12,14-hexaene

C24H15N3S2 — CID 59359438

IUPAC15-carbazol-9-yl-4-methyl-3,8-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7(11),9,12,14-hexaene
SMILESCc1cc2c3sccc3c3ncc(-n4c5ccccc5c5ccccc54)n3c2s1
InChIInChI=1S/C24H15N3S2/c1-14-12-18-22-17(10-11-28-22)23-25-13-21(27(23)24(18)29-14)26-19-8-4-2-6-15(19)16-7-3-5-9-20(16)26/h2-13H,1H3
InChIKeyMDJGFXALQNTNHJ-UHFFFAOYSA-N
MW409.54 g/mol
LogP7.17
Rot. Bonds1

About 15-carbazol-9-yl-4-methyl-3,8-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7(11),9,12,14-hexaene

15-carbazol-9-yl-4-methyl-3,8-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7(11),9,12,14-hexaene (PubChem CID 59359438) has the molecular formula C24H15N3S2 and a molecular weight of 409.54 g/mol. Its IUPAC name is 15-carbazol-9-yl-4-methyl-3,8-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7(11),9,12,14-hexaene.

Molecular Properties

Compound Name15-carbazol-9-yl-4-methyl-3,8-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7(11),9,12,14-hexaene
PubChem CID59359438
Molecular FormulaC24H15N3S2
Molecular Weight409.54 g/mol
Exact Mass409.07
IUPAC Name15-carbazol-9-yl-4-methyl-3,8-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7(11),9,12,14-hexaene
SMILESCc1cc2c3sccc3c3ncc(-n4c5ccccc5c5ccccc54)n3c2s1
InChIInChI=1S/C24H15N3S2/c1-14-12-18-22-17(10-11-28-22)23-25-13-21(27(23)24(18)29-14)26-19-8-4-2-6-15(19)16-7-3-5-9-20(16)26/h2-13H,1H3
InChIKeyMDJGFXALQNTNHJ-UHFFFAOYSA-N
XLogP7.17
TPSA22.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500409.54
LogP ≤ 57.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 15-carbazol-9-yl-4-methyl-3,8-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7(11),9,12,14-hexaene with MolForge

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Related Compounds

15-(3-carbazol-9-ylphenyl)-4,8-dimethyl-3,9-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7,10,12,14-hexaene
CID 59358364
3-carbazol-9-yl-2,5,11,17-tetrazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),3,5,7(12),8,10,14,16-octaene
CID 158990237
4-(4-carbazol-9-ylphenyl)-15-methyl-9-oxa-3-thia-1,8,13-triazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7,10,12,14-hexaene
CID 59358582
6-methyl-7-thia-3,9-diazahexacyclo[14.8.0.02,9.04,8.010,15.018,23]tetracosa-1(24),2,4(8),5,10,12,14,16,18,20,22-undecaene
CID 155769763
3-(2,3,4,5,6-pentamethylphenyl)imidazo[1,2-f]phenanthridine
CID 58162799
3-methyl-9-phenylpyrido[2,3-b]indole
CID 140770387
13-carbazol-9-yl-4-methyl-5,10-dithia-1,8,15-triazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),3,7(11),8,12,14-hexaene
CID 59359085
3-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]imidazo[1,2-f]phenanthridine
CID 170530717
3-pyridin-2-yl-9-(3,7,11-trithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl)pyrido[3,4-b]indole
CID 140711347
9-(6-bromothieno[3,2-b]thiophen-5-yl)carbazole
CID 146321312
14-carbazol-9-yl-9-methyl-8-thia-2,3-diazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7(11),9,13,15-heptaene
CID 59358801
6,7,8-tri(carbazol-9-yl)-[1]benzothiolo[2,3-b]pyrazine
CID 134351439

Frequently Asked Questions

What is the IUPAC name of 15-carbazol-9-yl-4-methyl-3,8-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7(11),9,12,14-hexaene?
The IUPAC name of 15-carbazol-9-yl-4-methyl-3,8-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7(11),9,12,14-hexaene (CID 59359438) is 15-carbazol-9-yl-4-methyl-3,8-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7(11),9,12,14-hexaene.
What is the SMILES notation for 15-carbazol-9-yl-4-methyl-3,8-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7(11),9,12,14-hexaene?
The canonical SMILES for 15-carbazol-9-yl-4-methyl-3,8-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7(11),9,12,14-hexaene is Cc1cc2c3sccc3c3ncc(-n4c5ccccc5c5ccccc54)n3c2s1.
What is the InChIKey of 15-carbazol-9-yl-4-methyl-3,8-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7(11),9,12,14-hexaene?
The InChIKey is MDJGFXALQNTNHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15N3S2/c1-14-12-18-22-17(10-11-28-22)23-25-13-21(27(23)24(18)29-14)26-19-8-4-2-6-15(19)16-7-3-5-9-20(16)26/h2-13H,1H3.
What are the key properties of 15-carbazol-9-yl-4-methyl-3,8-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7(11),9,12,14-hexaene?
15-carbazol-9-yl-4-methyl-3,8-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7(11),9,12,14-hexaene has a molecular weight of 409.54 g/mol, XLogP of 7.17, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 15-carbazol-9-yl-4-methyl-3,8-dithia-1,13-diazatetracyclo[10.3.0.02,6.07,11]pentadeca-2(6),4,7(11),9,12,14-hexaene is sourced from PubChem (CID 59359438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).