11-phenyl-8-(9-phenylcarbazol-3-yl)indolo[3,2-c][1,7]naphthyridine

C38H24N4 — CID 90336672

IUPAC11-phenyl-8-(9-phenylcarbazol-3-yl)indolo[3,2-c][1,7]naphthyridine
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4cnc6cnccc6c4n5-c4ccccc4)ccc32)cc1
InChIInChI=1S/C38H24N4/c1-3-9-27(10-4-1)41-35-14-8-7-13-29(35)31-21-25(15-17-36(31)41)26-16-18-37-32(22-26)33-23-40-34-24-39-20-19-30(34)38(33)42(37)28-11-5-2-6-12-28/h1-24H
InChIKeyXBWFATKVXCPQEG-UHFFFAOYSA-N
MW536.64 g/mol
LogP9.49
Rot. Bonds3

About 11-phenyl-8-(9-phenylcarbazol-3-yl)indolo[3,2-c][1,7]naphthyridine

11-phenyl-8-(9-phenylcarbazol-3-yl)indolo[3,2-c][1,7]naphthyridine (PubChem CID 90336672) has the molecular formula C38H24N4 and a molecular weight of 536.64 g/mol. Its IUPAC name is 11-phenyl-8-(9-phenylcarbazol-3-yl)indolo[3,2-c][1,7]naphthyridine.

Molecular Properties

Compound Name11-phenyl-8-(9-phenylcarbazol-3-yl)indolo[3,2-c][1,7]naphthyridine
PubChem CID90336672
Molecular FormulaC38H24N4
Molecular Weight536.64 g/mol
Exact Mass536.20
IUPAC Name11-phenyl-8-(9-phenylcarbazol-3-yl)indolo[3,2-c][1,7]naphthyridine
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4cnc6cnccc6c4n5-c4ccccc4)ccc32)cc1
InChIInChI=1S/C38H24N4/c1-3-9-27(10-4-1)41-35-14-8-7-13-29(35)31-21-25(15-17-36(31)41)26-16-18-37-32(22-26)33-23-40-34-24-39-20-19-30(34)38(33)42(37)28-11-5-2-6-12-28/h1-24H
InChIKeyXBWFATKVXCPQEG-UHFFFAOYSA-N
XLogP9.49
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms42
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500536.64
LogP ≤ 59.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 11-phenyl-8-(9-phenylcarbazol-3-yl)indolo[3,2-c][1,7]naphthyridine?
The IUPAC name of 11-phenyl-8-(9-phenylcarbazol-3-yl)indolo[3,2-c][1,7]naphthyridine (CID 90336672) is 11-phenyl-8-(9-phenylcarbazol-3-yl)indolo[3,2-c][1,7]naphthyridine.
What is the SMILES notation for 11-phenyl-8-(9-phenylcarbazol-3-yl)indolo[3,2-c][1,7]naphthyridine?
The canonical SMILES for 11-phenyl-8-(9-phenylcarbazol-3-yl)indolo[3,2-c][1,7]naphthyridine is c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4cnc6cnccc6c4n5-c4ccccc4)ccc32)cc1.
What is the InChIKey of 11-phenyl-8-(9-phenylcarbazol-3-yl)indolo[3,2-c][1,7]naphthyridine?
The InChIKey is XBWFATKVXCPQEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H24N4/c1-3-9-27(10-4-1)41-35-14-8-7-13-29(35)31-21-25(15-17-36(31)41)26-16-18-37-32(22-26)33-23-40-34-24-39-20-19-30(34)38(33)42(37)28-11-5-2-6-12-28/h1-24H.
What are the key properties of 11-phenyl-8-(9-phenylcarbazol-3-yl)indolo[3,2-c][1,7]naphthyridine?
11-phenyl-8-(9-phenylcarbazol-3-yl)indolo[3,2-c][1,7]naphthyridine has a molecular weight of 536.64 g/mol, XLogP of 9.49, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 11-phenyl-8-(9-phenylcarbazol-3-yl)indolo[3,2-c][1,7]naphthyridine is sourced from PubChem (CID 90336672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).