N-dibenzothiophen-1-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzothiophen-2-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N,2-diphenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)-2-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine

C186H122N10O4S2 — CID 159688611

IUPACN-dibenzothiophen-1-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzothiophen-2-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N,2-diphenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)-2-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine
SMILESC1=CC2c3ccc(N(c4ccccc4)c4ccc5ccc6ccc7nc(-c8ccccc8)oc7c6c5c4)cc3N(c3ccccc3)C2C=C1.C1=CC2c3ccc(N(c4ccccc4)c4ccc5ccc6ccc7nc(-c8ccccc8-c8ccccc8)oc7c6c5c4)cc3N(c3ccccc3)C2C=C1.c1ccc(-c2ccc(N(c3ccc4ccc5ccc6nc(-c7ccccc7)oc6c5c4c3)c3cccc4sc5ccccc5c34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4sc5ccccc5c4c3)c3ccc4ccc5ccc6nc(-c7ccccc7)oc6c5c4c3)cc2)cc1
InChIInChI=1S/C51H35N3O.C45H31N3O.2C45H28N2OS/c1-4-14-34(15-5-1)41-20-10-11-22-44(41)51-52-46-31-27-36-25-24-35-26-28-39(32-45(35)49(36)50(46)55-51)53(37-16-6-2-7-17-37)40-29-30-43-42-21-12-13-23-47(42)54(48(43)33-40)38-18-8-3-9-19-38;1-4-12-32(13-5-1)45-46-40-27-23-31-21-20-30-22-24-35(28-39(30)43(31)44(40)49-45)47(33-14-6-2-7-15-33)36-25-26-38-37-18-10-11-19-41(37)48(42(38)29-36)34-16-8-3-9-17-34;1-3-10-29(11-4-1)30-20-24-34(25-21-30)47(39-15-9-17-41-43(39)36-14-7-8-16-40(36)49-41)35-26-22-31-18-19-32-23-27-38-44(42(32)37(31)28-35)48-45(46-38)33-12-5-2-6-13-33;1-3-9-29(10-4-1)30-17-21-34(22-18-30)47(36-24-26-42-39(28-36)37-13-7-8-14-41(37)49-42)35-23-19-31-15-16-32-20-25-40-44(43(32)38(31)27-35)48-45(46-40)33-11-5-2-6-12-33/h1-33,42,47H;1-29,37,41H;2*1-28H
InChIKeyMWCWAZIFZSEFTK-UHFFFAOYSA-N
MW2625.22 g/mol
LogP52.28
Rot. Bonds21

About N-dibenzothiophen-1-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzothiophen-2-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N,2-diphenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)-2-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine

N-dibenzothiophen-1-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzothiophen-2-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N,2-diphenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)-2-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine (PubChem CID 159688611) has the molecular formula C186H122N10O4S2 and a molecular weight of 2625.22 g/mol. Its IUPAC name is N-dibenzothiophen-1-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzothiophen-2-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N,2-diphenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)-2-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine.

Molecular Properties

Compound NameN-dibenzothiophen-1-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzothiophen-2-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N,2-diphenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)-2-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine
PubChem CID159688611
Molecular FormulaC186H122N10O4S2
Molecular Weight2625.22 g/mol
Exact Mass2622.91
IUPAC NameN-dibenzothiophen-1-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzothiophen-2-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N,2-diphenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)-2-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine
SMILESC1=CC2c3ccc(N(c4ccccc4)c4ccc5ccc6ccc7nc(-c8ccccc8)oc7c6c5c4)cc3N(c3ccccc3)C2C=C1.C1=CC2c3ccc(N(c4ccccc4)c4ccc5ccc6ccc7nc(-c8ccccc8-c8ccccc8)oc7c6c5c4)cc3N(c3ccccc3)C2C=C1.c1ccc(-c2ccc(N(c3ccc4ccc5ccc6nc(-c7ccccc7)oc6c5c4c3)c3cccc4sc5ccccc5c34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4sc5ccccc5c4c3)c3ccc4ccc5ccc6nc(-c7ccccc7)oc6c5c4c3)cc2)cc1
InChIInChI=1S/C51H35N3O.C45H31N3O.2C45H28N2OS/c1-4-14-34(15-5-1)41-20-10-11-22-44(41)51-52-46-31-27-36-25-24-35-26-28-39(32-45(35)49(36)50(46)55-51)53(37-16-6-2-7-17-37)40-29-30-43-42-21-12-13-23-47(42)54(48(43)33-40)38-18-8-3-9-19-38;1-4-12-32(13-5-1)45-46-40-27-23-31-21-20-30-22-24-35(28-39(30)43(31)44(40)49-45)47(33-14-6-2-7-15-33)36-25-26-38-37-18-10-11-19-41(37)48(42(38)29-36)34-16-8-3-9-17-34;1-3-10-29(11-4-1)30-20-24-34(25-21-30)47(39-15-9-17-41-43(39)36-14-7-8-16-40(36)49-41)35-26-22-31-18-19-32-23-27-38-44(42(32)37(31)28-35)48-45(46-38)33-12-5-2-6-13-33;1-3-9-29(10-4-1)30-17-21-34(22-18-30)47(36-24-26-42-39(28-36)37-13-7-8-14-41(37)49-42)35-23-19-31-15-16-32-20-25-40-44(43(32)38(31)27-35)48-45(46-40)33-11-5-2-6-12-33/h1-33,42,47H;1-29,37,41H;2*1-28H
InChIKeyMWCWAZIFZSEFTK-UHFFFAOYSA-N
XLogP52.28
TPSA123.56 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds21
Heavy Atoms202
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002625.22
LogP ≤ 552.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze N-dibenzothiophen-1-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzothiophen-2-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N,2-diphenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)-2-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-dibenzothiophen-1-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzothiophen-2-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N,2-diphenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)-2-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine?
The IUPAC name of N-dibenzothiophen-1-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzothiophen-2-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N,2-diphenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)-2-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine (CID 159688611) is N-dibenzothiophen-1-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzothiophen-2-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N,2-diphenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)-2-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine.
What is the SMILES notation for N-dibenzothiophen-1-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzothiophen-2-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N,2-diphenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)-2-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine?
The canonical SMILES for N-dibenzothiophen-1-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzothiophen-2-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N,2-diphenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)-2-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine is C1=CC2c3ccc(N(c4ccccc4)c4ccc5ccc6ccc7nc(-c8ccccc8)oc7c6c5c4)cc3N(c3ccccc3)C2C=C1.C1=CC2c3ccc(N(c4ccccc4)c4ccc5ccc6ccc7nc(-c8ccccc8-c8ccccc8)oc7c6c5c4)cc3N(c3ccccc3)C2C=C1.c1ccc(-c2ccc(N(c3ccc4ccc5ccc6nc(-c7ccccc7)oc6c5c4c3)c3cccc4sc5ccccc5c34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4sc5ccccc5c4c3)c3ccc4ccc5ccc6nc(-c7ccccc7)oc6c5c4c3)cc2)cc1.
What is the InChIKey of N-dibenzothiophen-1-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzothiophen-2-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N,2-diphenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)-2-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine?
The InChIKey is MWCWAZIFZSEFTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H35N3O.C45H31N3O.2C45H28N2OS/c1-4-14-34(15-5-1)41-20-10-11-22-44(41)51-52-46-31-27-36-25-24-35-26-28-39(32-45(35)49(36)50(46)55-51)53(37-16-6-2-7-17-37)40-29-30-43-42-21-12-13-23-47(42)54(48(43)33-40)38-18-8-3-9-19-38;1-4-12-32(13-5-1)45-46-40-27-23-31-21-20-30-22-24-35(28-39(30)43(31)44(40)49-45)47(33-14-6-2-7-15-33)36-25-26-38-37-18-10-11-19-41(37)48(42(38)29-36)34-16-8-3-9-17-34;1-3-10-29(11-4-1)30-20-24-34(25-21-30)47(39-15-9-17-41-43(39)36-14-7-8-16-40(36)49-41)35-26-22-31-18-19-32-23-27-38-44(42(32)37(31)28-35)48-45(46-38)33-12-5-2-6-13-33;1-3-9-29(10-4-1)30-17-21-34(22-18-30)47(36-24-26-42-39(28-36)37-13-7-8-14-41(37)49-42)35-23-19-31-15-16-32-20-25-40-44(43(32)38(31)27-35)48-45(46-40)33-11-5-2-6-12-33/h1-33,42,47H;1-29,37,41H;2*1-28H.
What are the key properties of N-dibenzothiophen-1-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzothiophen-2-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N,2-diphenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)-2-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine?
N-dibenzothiophen-1-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzothiophen-2-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N,2-diphenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)-2-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine has a molecular weight of 2625.22 g/mol, XLogP of 52.28, 21 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzothiophen-1-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzothiophen-2-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N,2-diphenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine;N-phenyl-N-(9-phenyl-4b,8a-dihydrocarbazol-2-yl)-2-(2-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine is sourced from PubChem (CID 159688611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).