7H-benzo[c]carbazole;6H-benzo[c]chromene;benzo[c]chromen-6-one;1,3,2-benzodithiazole;9H-carbazole;dibenzofuran;dibenzothiophene;dibenzothiophene 5,5-dioxide;bis(9,10-dihydroacridine);naphtho[2,1-b][1]benzofuran;naphtho[2,1-b][1]benzothiole;10H-phenothiazine;10H-phenoxazine;pyridine;pyrimidine;quinoline;1,3,5-triazine

C199H146N14O8S6 — CID 160554958

About 7H-benzo[c]carbazole;6H-benzo[c]chromene;benzo[c]chromen-6-one;1,3,2-benzodithiazole;9H-carbazole;dibenzofuran;dibenzothiophene;dibenzothiophene 5,5-dioxide;bis(9,10-dihydroacridine);naphtho[2,1-b][1]benzofuran;naphtho[2,1-b][1]benzothiole;10H-phenothiazine;10H-phenoxazine;pyridine;pyrimidine;quinoline;1,3,5-triazine

7H-benzo[c]carbazole;6H-benzo[c]chromene;benzo[c]chromen-6-one;1,3,2-benzodithiazole;9H-carbazole;dibenzofuran;dibenzothiophene;dibenzothiophene 5,5-dioxide;bis(9,10-dihydroacridine);naphtho[2,1-b][1]benzofuran;naphtho[2,1-b][1]benzothiole;10H-phenothiazine;10H-phenoxazine;pyridine;pyrimidine;quinoline;1,3,5-triazine (PubChem CID 160554958) has the molecular formula C199H146N14O8S6 and a molecular weight of 3053.85 g/mol. Its IUPAC name is 7H-benzo[c]carbazole;6H-benzo[c]chromene;benzo[c]chromen-6-one;1,3,2-benzodithiazole;9H-carbazole;dibenzofuran;dibenzothiophene;dibenzothiophene 5,5-dioxide;bis(9,10-dihydroacridine);naphtho[2,1-b][1]benzofuran;naphtho[2,1-b][1]benzothiole;10H-phenothiazine;10H-phenoxazine;pyridine;pyrimidine;quinoline;1,3,5-triazine.

Molecular Properties

• Compound Name: 7H-benzo[c]carbazole;6H-benzo[c]chromene;benzo[c]chromen-6-one;1,3,2-benzodithiazole;9H-carbazole;dibenzofuran;dibenzothiophene;dibenzothiophene 5,5-dioxide;bis(9,10-dihydroacridine);naphtho[2,1-b][1]benzofuran;naphtho[2,1-b][1]benzothiole;10H-phenothiazine;10H-phenoxazine;pyridine;pyrimidine;quinoline;1,3,5-triazine
• PubChem CID: 160554958
• Molecular Formula: C199H146N14O8S6
• Molecular Weight: 3053.85 g/mol
• Exact Mass: 3050.98
• IUPAC Name: 7H-benzo[c]carbazole;6H-benzo[c]chromene;benzo[c]chromen-6-one;1,3,2-benzodithiazole;9H-carbazole;dibenzofuran;dibenzothiophene;dibenzothiophene 5,5-dioxide;bis(9,10-dihydroacridine);naphtho[2,1-b][1]benzofuran;naphtho[2,1-b][1]benzothiole;10H-phenothiazine;10H-phenoxazine;pyridine;pyrimidine;quinoline;1,3,5-triazine
• SMILES: O=S1(=O)c2ccccc2-c2ccccc21.O=c1oc2ccccc2c2ccccc12.c1ccc2c(c1)COc1ccccc1-2.c1ccc2c(c1)Cc1ccccc1N2.c1ccc2c(c1)Cc1ccccc1N2.c1ccc2c(c1)Nc1ccccc1O2.c1ccc2c(c1)Nc1ccccc1S2.c1ccc2c(c1)SNS2.c1ccc2c(c1)[nH]c1ccccc12.c1ccc2c(c1)ccc1[nH]c3ccccc3c12.c1ccc2c(c1)ccc1oc3ccccc3c12.c1ccc2c(c1)ccc1sc3ccccc3c12.c1ccc2c(c1)oc1ccccc12.c1ccc2c(c1)sc1ccccc12.c1ccc2ncccc2c1.c1ccncc1.c1cncnc1.c1ncncn1
• InChI: InChI=1S/C16H11N.C16H10O.C16H10S.2C13H11N.C13H8O2.C13H10O.C12H9NO.C12H9NS.C12H9N.C12H8O2S.C12H8O.C12H8S.C9H7N.C6H5NS2.C5H5N.C4H4N2.C3H3N3/c3*1-2-6-12-11(5-1)9-10-15-16(12)13-7-3-4-8-14(13)17-15;2*1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12;14-13-11-7-2-1-5-9(11)10-6-3-4-8-12(10)15-13;1-2-6-11-10(5-1)9-14-13-8-4-3-7-12(11)13;2*1-3-7-11-9(5-1)13-10-6-2-4-8-12(10)14-11;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;13-15(14)11-7-3-1-5-9(11)10-6-2-4-8-12(10)15;2*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-2-6-9-8(4-1)5-3-7-10-9;1-2-4-6-5(3-1)8-7-9-6;1-2-4-6-5-3-1;1-2-5-4-6-3-1;1-4-2-6-3-5-1/h1-10,17H;2*1-10H;2*1-8,14H,9H2;1-8H;1-8H,9H2;2*1-8,13H;1-8,13H;1-8H;2*1-8H;1-7H;1-4,7H;1-5H;1-4H;1-3H
• InChIKey: QYODAZYLOYQQLU-UHFFFAOYSA-N
• XLogP: 54.14
• TPSA: 291.05 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 25
• Heavy Atoms: 227
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3053.85
LogP ≤ 5	54.14
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'het_thio_666_A(13)', 'substructure': 'N/A'}, {'alert_name': 'cumarine', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'sulphur_nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7H-benzo[c]carbazole;6H-benzo[c]chromene;benzo[c]chromen-6-one;1,3,2-benzodithiazole;9H-carbazole;dibenzofuran;dibenzothiophene;dibenzothiophene 5,5-dioxide;bis(9,10-dihydroacridine);naphtho[2,1-b][1]benzofuran;naphtho[2,1-b][1]benzothiole;10H-phenothiazine;10H-phenoxazine;pyridine;pyrimidine;quinoline;1,3,5-triazine?

The IUPAC name of 7H-benzo[c]carbazole;6H-benzo[c]chromene;benzo[c]chromen-6-one;1,3,2-benzodithiazole;9H-carbazole;dibenzofuran;dibenzothiophene;dibenzothiophene 5,5-dioxide;bis(9,10-dihydroacridine);naphtho[2,1-b][1]benzofuran;naphtho[2,1-b][1]benzothiole;10H-phenothiazine;10H-phenoxazine;pyridine;pyrimidine;quinoline;1,3,5-triazine (CID 160554958) is 7H-benzo[c]carbazole;6H-benzo[c]chromene;benzo[c]chromen-6-one;1,3,2-benzodithiazole;9H-carbazole;dibenzofuran;dibenzothiophene;dibenzothiophene 5,5-dioxide;bis(9,10-dihydroacridine);naphtho[2,1-b][1]benzofuran;naphtho[2,1-b][1]benzothiole;10H-phenothiazine;10H-phenoxazine;pyridine;pyrimidine;quinoline;1,3,5-triazine.

What is the SMILES notation for 7H-benzo[c]carbazole;6H-benzo[c]chromene;benzo[c]chromen-6-one;1,3,2-benzodithiazole;9H-carbazole;dibenzofuran;dibenzothiophene;dibenzothiophene 5,5-dioxide;bis(9,10-dihydroacridine);naphtho[2,1-b][1]benzofuran;naphtho[2,1-b][1]benzothiole;10H-phenothiazine;10H-phenoxazine;pyridine;pyrimidine;quinoline;1,3,5-triazine?

The canonical SMILES for 7H-benzo[c]carbazole;6H-benzo[c]chromene;benzo[c]chromen-6-one;1,3,2-benzodithiazole;9H-carbazole;dibenzofuran;dibenzothiophene;dibenzothiophene 5,5-dioxide;bis(9,10-dihydroacridine);naphtho[2,1-b][1]benzofuran;naphtho[2,1-b][1]benzothiole;10H-phenothiazine;10H-phenoxazine;pyridine;pyrimidine;quinoline;1,3,5-triazine is O=S1(=O)c2ccccc2-c2ccccc21.O=c1oc2ccccc2c2ccccc12.c1ccc2c(c1)COc1ccccc1-2.c1ccc2c(c1)Cc1ccccc1N2.c1ccc2c(c1)Cc1ccccc1N2.c1ccc2c(c1)Nc1ccccc1O2.c1ccc2c(c1)Nc1ccccc1S2.c1ccc2c(c1)SNS2.c1ccc2c(c1)[nH]c1ccccc12.c1ccc2c(c1)ccc1[nH]c3ccccc3c12.c1ccc2c(c1)ccc1oc3ccccc3c12.c1ccc2c(c1)ccc1sc3ccccc3c12.c1ccc2c(c1)oc1ccccc12.c1ccc2c(c1)sc1ccccc12.c1ccc2ncccc2c1.c1ccncc1.c1cncnc1.c1ncncn1.

What is the InChIKey of 7H-benzo[c]carbazole;6H-benzo[c]chromene;benzo[c]chromen-6-one;1,3,2-benzodithiazole;9H-carbazole;dibenzofuran;dibenzothiophene;dibenzothiophene 5,5-dioxide;bis(9,10-dihydroacridine);naphtho[2,1-b][1]benzofuran;naphtho[2,1-b][1]benzothiole;10H-phenothiazine;10H-phenoxazine;pyridine;pyrimidine;quinoline;1,3,5-triazine?

The InChIKey is QYODAZYLOYQQLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N.C16H10O.C16H10S.2C13H11N.C13H8O2.C13H10O.C12H9NO.C12H9NS.C12H9N.C12H8O2S.C12H8O.C12H8S.C9H7N.C6H5NS2.C5H5N.C4H4N2.C3H3N3/c3*1-2-6-12-11(5-1)9-10-15-16(12)13-7-3-4-8-14(13)17-15;2*1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12;14-13-11-7-2-1-5-9(11)10-6-3-4-8-12(10)15-13;1-2-6-11-10(5-1)9-14-13-8-4-3-7-12(11)13;2*1-3-7-11-9(5-1)13-10-6-2-4-8-12(10)14-11;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;13-15(14)11-7-3-1-5-9(11)10-6-2-4-8-12(10)15;2*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-2-6-9-8(4-1)5-3-7-10-9;1-2-4-6-5(3-1)8-7-9-6;1-2-4-6-5-3-1;1-2-5-4-6-3-1;1-4-2-6-3-5-1/h1-10,17H;2*1-10H;2*1-8,14H,9H2;1-8H;1-8H,9H2;2*1-8,13H;1-8,13H;1-8H;2*1-8H;1-7H;1-4,7H;1-5H;1-4H;1-3H.

What are the key properties of 7H-benzo[c]carbazole;6H-benzo[c]chromene;benzo[c]chromen-6-one;1,3,2-benzodithiazole;9H-carbazole;dibenzofuran;dibenzothiophene;dibenzothiophene 5,5-dioxide;bis(9,10-dihydroacridine);naphtho[2,1-b][1]benzofuran;naphtho[2,1-b][1]benzothiole;10H-phenothiazine;10H-phenoxazine;pyridine;pyrimidine;quinoline;1,3,5-triazine?

7H-benzo[c]carbazole;6H-benzo[c]chromene;benzo[c]chromen-6-one;1,3,2-benzodithiazole;9H-carbazole;dibenzofuran;dibenzothiophene;dibenzothiophene 5,5-dioxide;bis(9,10-dihydroacridine);naphtho[2,1-b][1]benzofuran;naphtho[2,1-b][1]benzothiole;10H-phenothiazine;10H-phenoxazine;pyridine;pyrimidine;quinoline;1,3,5-triazine has a molecular weight of 3053.85 g/mol, XLogP of 54.14, 0 rotatable bonds, 7 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 7H-benzo[c]carbazole;6H-benzo[c]chromene;benzo[c]chromen-6-one;1,3,2-benzodithiazole;9H-carbazole;dibenzofuran;dibenzothiophene;dibenzothiophene 5,5-dioxide;bis(9,10-dihydroacridine);naphtho[2,1-b][1]benzofuran;naphtho[2,1-b][1]benzothiole;10H-phenothiazine;10H-phenoxazine;pyridine;pyrimidine;quinoline;1,3,5-triazine is sourced from PubChem (CID 160554958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).