7-O-tert-butyl 5-O-ethyl benzo[c]carbazole-5,7-dicarboxylate

C24H23NO4 — CID 122233617

IUPAC7-O-tert-butyl 5-O-ethyl benzo[c]carbazole-5,7-dicarboxylate
SMILESCCOC(=O)c1cc2c(c3ccccc13)c1ccccc1n2C(=O)OC(C)(C)C
InChIInChI=1S/C24H23NO4/c1-5-28-22(26)18-14-20-21(16-11-7-6-10-15(16)18)17-12-8-9-13-19(17)25(20)23(27)29-24(2,3)4/h6-14H,5H2,1-4H3
InChIKeyCQKVHGRKFQUGCI-UHFFFAOYSA-N
MW389.45 g/mol
LogP5.91
Rot. Bonds2

About 7-O-tert-butyl 5-O-ethyl benzo[c]carbazole-5,7-dicarboxylate

7-O-tert-butyl 5-O-ethyl benzo[c]carbazole-5,7-dicarboxylate (PubChem CID 122233617) has the molecular formula C24H23NO4 and a molecular weight of 389.45 g/mol. Its IUPAC name is 7-O-tert-butyl 5-O-ethyl benzo[c]carbazole-5,7-dicarboxylate.

Molecular Properties

Compound Name7-O-tert-butyl 5-O-ethyl benzo[c]carbazole-5,7-dicarboxylate
PubChem CID122233617
Molecular FormulaC24H23NO4
Molecular Weight389.45 g/mol
Exact Mass389.16
IUPAC Name7-O-tert-butyl 5-O-ethyl benzo[c]carbazole-5,7-dicarboxylate
SMILESCCOC(=O)c1cc2c(c3ccccc13)c1ccccc1n2C(=O)OC(C)(C)C
InChIInChI=1S/C24H23NO4/c1-5-28-22(26)18-14-20-21(16-11-7-6-10-15(16)18)17-12-8-9-13-19(17)25(20)23(27)29-24(2,3)4/h6-14H,5H2,1-4H3
InChIKeyCQKVHGRKFQUGCI-UHFFFAOYSA-N
XLogP5.91
TPSA57.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.45
LogP ≤ 55.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 7-O-tert-butyl 5-O-ethyl benzo[c]carbazole-5,7-dicarboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-O-tert-butyl 2-O-ethyl 3-hydroxyindole-1,2-dicarboxylate
CID 133055982
1-O-tert-butyl 2-O-ethyl 4-fluoroindole-1,2-dicarboxylate
CID 58941047
1-O-tert-butyl 2-O-ethyl 3-(2-ethoxy-2-oxoethyl)indole-1,2-dicarboxylate
CID 59409118
9-O-tert-butyl 4-O-methyl carbazole-4,9-dicarboxylate
CID 132516778
tert-butyl 3-methyl-2-[2-[3-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]ethenyl]indole-1-carboxylate
CID 162263594
9-O-tert-butyl 3-O-methyl 4-methyl-1-[(2-methylpropan-2-yl)oxycarbonyloxy]carbazole-3,9-dicarboxylate
CID 102142993
1-O-tert-butyl 3-O-ethyl 2,5-dimethyl-4-phenylpyrrole-1,3-dicarboxylate
CID 135007945
tert-butyl 3-(2-methoxy-2-oxoethyl)-2-methylindole-1-carboxylate
CID 118368388
1-O-tert-butyl 3-O-ethyl 2-bromo-5-ethylpyrrole-1,3-dicarboxylate
CID 170683440
tert-butyl 1,3-dimethyl-4-phenylpyrido[3,4-b]indole-9-carboxylate
CID 53468109
tert-butyl 2,3-dichloroindole-1-carboxylate
CID 122227437
1-O-tert-butyl 2-O-ethyl 5-O-methyl 3-aminoindole-1,2,5-tricarboxylate
CID 171805338

Frequently Asked Questions

What is the IUPAC name of 7-O-tert-butyl 5-O-ethyl benzo[c]carbazole-5,7-dicarboxylate?
The IUPAC name of 7-O-tert-butyl 5-O-ethyl benzo[c]carbazole-5,7-dicarboxylate (CID 122233617) is 7-O-tert-butyl 5-O-ethyl benzo[c]carbazole-5,7-dicarboxylate.
What is the SMILES notation for 7-O-tert-butyl 5-O-ethyl benzo[c]carbazole-5,7-dicarboxylate?
The canonical SMILES for 7-O-tert-butyl 5-O-ethyl benzo[c]carbazole-5,7-dicarboxylate is CCOC(=O)c1cc2c(c3ccccc13)c1ccccc1n2C(=O)OC(C)(C)C.
What is the InChIKey of 7-O-tert-butyl 5-O-ethyl benzo[c]carbazole-5,7-dicarboxylate?
The InChIKey is CQKVHGRKFQUGCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO4/c1-5-28-22(26)18-14-20-21(16-11-7-6-10-15(16)18)17-12-8-9-13-19(17)25(20)23(27)29-24(2,3)4/h6-14H,5H2,1-4H3.
What are the key properties of 7-O-tert-butyl 5-O-ethyl benzo[c]carbazole-5,7-dicarboxylate?
7-O-tert-butyl 5-O-ethyl benzo[c]carbazole-5,7-dicarboxylate has a molecular weight of 389.45 g/mol, XLogP of 5.91, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-O-tert-butyl 5-O-ethyl benzo[c]carbazole-5,7-dicarboxylate is sourced from PubChem (CID 122233617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).