5-[4-(4-methylphenyl)phenyl]-10,11-dihydro-[1]benzofuro[3,2-c]carbazole

C31H23NO — CID 144907071

IUPAC5-[4-(4-methylphenyl)phenyl]-10,11-dihydro-[1]benzofuro[3,2-c]carbazole
SMILESCc1ccc(-c2ccc(-n3c4ccccc4c4c5oc6c(c5ccc43)C=CCC6)cc2)cc1
InChIInChI=1S/C31H23NO/c1-20-10-12-21(13-11-20)22-14-16-23(17-15-22)32-27-8-4-2-7-26(27)30-28(32)19-18-25-24-6-3-5-9-29(24)33-31(25)30/h2-4,6-8,10-19H,5,9H2,1H3
InChIKeyGYJVTUKMDJDVSS-UHFFFAOYSA-N
MW425.53 g/mol
LogP8.46
Rot. Bonds2

About 5-[4-(4-methylphenyl)phenyl]-10,11-dihydro-[1]benzofuro[3,2-c]carbazole

5-[4-(4-methylphenyl)phenyl]-10,11-dihydro-[1]benzofuro[3,2-c]carbazole (PubChem CID 144907071) has the molecular formula C31H23NO and a molecular weight of 425.53 g/mol. Its IUPAC name is 5-[4-(4-methylphenyl)phenyl]-10,11-dihydro-[1]benzofuro[3,2-c]carbazole.

Molecular Properties

Compound Name5-[4-(4-methylphenyl)phenyl]-10,11-dihydro-[1]benzofuro[3,2-c]carbazole
PubChem CID144907071
Molecular FormulaC31H23NO
Molecular Weight425.53 g/mol
Exact Mass425.18
IUPAC Name5-[4-(4-methylphenyl)phenyl]-10,11-dihydro-[1]benzofuro[3,2-c]carbazole
SMILESCc1ccc(-c2ccc(-n3c4ccccc4c4c5oc6c(c5ccc43)C=CCC6)cc2)cc1
InChIInChI=1S/C31H23NO/c1-20-10-12-21(13-11-20)22-14-16-23(17-15-22)32-27-8-4-2-7-26(27)30-28(32)19-18-25-24-6-3-5-9-29(24)33-31(25)30/h2-4,6-8,10-19H,5,9H2,1H3
InChIKeyGYJVTUKMDJDVSS-UHFFFAOYSA-N
XLogP8.46
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500425.53
LogP ≤ 58.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-[4-[4-[4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole
CID 149479676
4-N-[4-(6,7-dihydrodibenzofuran-4-yl)phenyl]-1-N,1-N-diphenyl-4-N-(9-phenylcarbazol-3-yl)benzene-1,4-diamine
CID 70671807
5-[4-[4-(3-phenylcarbazol-9-yl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole
CID 167193138
5-(4-phenylphenyl)-10,11-dihydro-[1]benzothiolo[3,2-c]carbazole
CID 144884862
9-(6,7-dihydrodibenzofuran-2-yl)-3-[3-[9-(6,7-dihydrodibenzofuran-2-yl)carbazol-3-yl]phenyl]carbazole
CID 144541028
24-(3-cyclohexa-1,5-dien-1-ylphenyl)-6,10-diphenyl-15-oxa-6,24-diazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7(12),8,10,17(25),18,20,22,26-dodecaene;ethane
CID 144604490
24-(4-methylphenyl)-3-phenyl-3,24-diazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11(16),12,18,20,22-decaene
CID 145080123
3-(27-oxa-13-azaheptacyclo[15.11.0.02,14.03,12.04,9.020,28.021,26]octacosa-1(17),2(14),3(12),4,6,8,10,15,18,20(28),21(26),22-dodecaen-13-yl)-N-phenyl-N-(4-phenylphenyl)aniline
CID 163624400
9-(4-carbazol-9-ylphenyl)-14-(3,5-diphenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15(20),18-octaene
CID 130184110
6-(4-dibenzofuran-2-ylphenyl)-24-phenyl-15-oxa-6,24-diazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7,9,11,17(25),18,20,22,26-dodecaene;ethane
CID 144604260
24-(6,7-dihydrodibenzofuran-2-yl)-6-(9-phenylcarbazol-3-yl)-15-oxa-6,24-diazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7,9,11,17(25),19,21,26-undecaene
CID 163597803
3-dibenzofuran-4-yl-6-(6,7-dihydrodibenzofuran-4-yl)-9-(3-triphenylen-2-ylphenyl)carbazole
CID 88573967

Frequently Asked Questions

What is the IUPAC name of 5-[4-(4-methylphenyl)phenyl]-10,11-dihydro-[1]benzofuro[3,2-c]carbazole?
The IUPAC name of 5-[4-(4-methylphenyl)phenyl]-10,11-dihydro-[1]benzofuro[3,2-c]carbazole (CID 144907071) is 5-[4-(4-methylphenyl)phenyl]-10,11-dihydro-[1]benzofuro[3,2-c]carbazole.
What is the SMILES notation for 5-[4-(4-methylphenyl)phenyl]-10,11-dihydro-[1]benzofuro[3,2-c]carbazole?
The canonical SMILES for 5-[4-(4-methylphenyl)phenyl]-10,11-dihydro-[1]benzofuro[3,2-c]carbazole is Cc1ccc(-c2ccc(-n3c4ccccc4c4c5oc6c(c5ccc43)C=CCC6)cc2)cc1.
What is the InChIKey of 5-[4-(4-methylphenyl)phenyl]-10,11-dihydro-[1]benzofuro[3,2-c]carbazole?
The InChIKey is GYJVTUKMDJDVSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H23NO/c1-20-10-12-21(13-11-20)22-14-16-23(17-15-22)32-27-8-4-2-7-26(27)30-28(32)19-18-25-24-6-3-5-9-29(24)33-31(25)30/h2-4,6-8,10-19H,5,9H2,1H3.
What are the key properties of 5-[4-(4-methylphenyl)phenyl]-10,11-dihydro-[1]benzofuro[3,2-c]carbazole?
5-[4-(4-methylphenyl)phenyl]-10,11-dihydro-[1]benzofuro[3,2-c]carbazole has a molecular weight of 425.53 g/mol, XLogP of 8.46, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(4-methylphenyl)phenyl]-10,11-dihydro-[1]benzofuro[3,2-c]carbazole is sourced from PubChem (CID 144907071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).