2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile

C120H76N12S4 — CID 160825245

IUPAC2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile
SMILESN#Cc1ccc(-c2ccc(-c3cccc(N4c5ccccc5Sc5ccccc54)c3)cc2)cn1.N#Cc1cccnc1-c1ccc(-c2cccc(N3c4ccccc4Sc4ccccc43)c2)cc1.N#Cc1ccnc(-c2ccc(-c3cccc(N4c5ccccc5Sc5ccccc54)c3)cc2)c1.N#Cc1ncccc1-c1ccc(-c2cccc(N3c4ccccc4Sc4ccccc43)c2)cc1
InChIInChI=1S/4C30H19N3S/c31-20-24-8-6-18-32-30(24)22-16-14-21(15-17-22)23-7-5-9-25(19-23)33-26-10-1-3-12-28(26)34-29-13-4-2-11-27(29)33;31-20-26-25(9-6-18-32-26)22-16-14-21(15-17-22)23-7-5-8-24(19-23)33-27-10-1-3-12-29(27)34-30-13-4-2-11-28(30)33;31-20-21-16-17-32-26(18-21)23-14-12-22(13-15-23)24-6-5-7-25(19-24)33-27-8-1-3-10-29(27)34-30-11-4-2-9-28(30)33;31-19-25-17-16-24(20-32-25)22-14-12-21(13-15-22)23-6-5-7-26(18-23)33-27-8-1-3-10-29(27)34-30-11-4-2-9-28(30)33/h3*1-19H;1-18,20H
InChIKeySGBMWBLASMZRDN-UHFFFAOYSA-N
MW1814.28 g/mol
LogP32.89
Rot. Bonds12

About 2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile

2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile (PubChem CID 160825245) has the molecular formula C120H76N12S4 and a molecular weight of 1814.28 g/mol. Its IUPAC name is 2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile.

Molecular Properties

Compound Name2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile
PubChem CID160825245
Molecular FormulaC120H76N12S4
Molecular Weight1814.28 g/mol
Exact Mass1812.52
IUPAC Name2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile
SMILESN#Cc1ccc(-c2ccc(-c3cccc(N4c5ccccc5Sc5ccccc54)c3)cc2)cn1.N#Cc1cccnc1-c1ccc(-c2cccc(N3c4ccccc4Sc4ccccc43)c2)cc1.N#Cc1ccnc(-c2ccc(-c3cccc(N4c5ccccc5Sc5ccccc54)c3)cc2)c1.N#Cc1ncccc1-c1ccc(-c2cccc(N3c4ccccc4Sc4ccccc43)c2)cc1
InChIInChI=1S/4C30H19N3S/c31-20-24-8-6-18-32-30(24)22-16-14-21(15-17-22)23-7-5-9-25(19-23)33-26-10-1-3-12-28(26)34-29-13-4-2-11-27(29)33;31-20-26-25(9-6-18-32-26)22-16-14-21(15-17-22)23-7-5-8-24(19-23)33-27-10-1-3-12-29(27)34-30-13-4-2-11-28(30)33;31-20-21-16-17-32-26(18-21)23-14-12-22(13-15-23)24-6-5-7-25(19-24)33-27-8-1-3-10-29(27)34-30-11-4-2-9-28(30)33;31-19-25-17-16-24(20-32-25)22-14-12-21(13-15-22)23-6-5-7-26(18-23)33-27-8-1-3-10-29(27)34-30-11-4-2-9-28(30)33/h3*1-19H;1-18,20H
InChIKeySGBMWBLASMZRDN-UHFFFAOYSA-N
XLogP32.89
TPSA159.68 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds12
Heavy Atoms136
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001814.28
LogP ≤ 532.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile with MolForge

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Related Compounds

2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile
CID 146543302
3-[3-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile
CID 146542766
2-(3-phenoxazin-10-ylphenyl)pyridine-3-carbonitrile;2-(3-phenoxazin-10-ylphenyl)pyridine-4-carbonitrile;4-(3-phenoxazin-10-ylphenyl)pyridine-2-carbonitrile;4-(3-phenoxazin-10-ylphenyl)pyridine-3-carbonitrile;5-(3-phenoxazin-10-ylphenyl)pyridine-2-carbonitrile
CID 162265903
2-[4-[3-(10-phenylphenazin-5-yl)phenyl]phenyl]pyridine-3-carbonitrile
CID 146543470
4-(3-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile
CID 146542786
9-[3-[3-(2-cyano-3-pyridinyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[3-[3-(3-cyano-2-pyridinyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[3-[3-(4-cyano-2-pyridinyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[3-[3-(5-cyano-2-pyridinyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[3-[3-(6-cyano-2-pyridinyl)phenyl]phenyl]carbazole-3-carbonitrile
CID 162214760
2-[4-[3-(9,9-dimethylacridin-10-yl)phenyl]phenyl]pyridine-4-carbonitrile
CID 146542724
3-[4-[3-(9,9-dimethylacridin-10-yl)phenyl]phenyl]pyridine-2-carbonitrile
CID 146542714
5-(2-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile
CID 146538293
2-[2-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]pyridine-3-carbonitrile;2-[2-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]pyridine-4-carbonitrile;3-[2-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]pyridine-2-carbonitrile;5-[2-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]pyridine-2-carbonitrile
CID 157416214
2-[3-[2-(10-phenylphenazin-5-yl)phenyl]phenyl]pyridine-4-carbonitrile
CID 146542824
CID 163675182
CID 163675182

Frequently Asked Questions

What is the IUPAC name of 2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile?
The IUPAC name of 2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile (CID 160825245) is 2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile.
What is the SMILES notation for 2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile?
The canonical SMILES for 2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile is N#Cc1ccc(-c2ccc(-c3cccc(N4c5ccccc5Sc5ccccc54)c3)cc2)cn1.N#Cc1cccnc1-c1ccc(-c2cccc(N3c4ccccc4Sc4ccccc43)c2)cc1.N#Cc1ccnc(-c2ccc(-c3cccc(N4c5ccccc5Sc5ccccc54)c3)cc2)c1.N#Cc1ncccc1-c1ccc(-c2cccc(N3c4ccccc4Sc4ccccc43)c2)cc1.
What is the InChIKey of 2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile?
The InChIKey is SGBMWBLASMZRDN-UHFFFAOYSA-N. The full InChI is InChI=1S/4C30H19N3S/c31-20-24-8-6-18-32-30(24)22-16-14-21(15-17-22)23-7-5-9-25(19-23)33-26-10-1-3-12-28(26)34-29-13-4-2-11-27(29)33;31-20-26-25(9-6-18-32-26)22-16-14-21(15-17-22)23-7-5-8-24(19-23)33-27-10-1-3-12-29(27)34-30-13-4-2-11-28(30)33;31-20-21-16-17-32-26(18-21)23-14-12-22(13-15-23)24-6-5-7-25(19-24)33-27-8-1-3-10-29(27)34-30-11-4-2-9-28(30)33;31-19-25-17-16-24(20-32-25)22-14-12-21(13-15-22)23-6-5-7-26(18-23)33-27-8-1-3-10-29(27)34-30-11-4-2-9-28(30)33/h3*1-19H;1-18,20H.
What are the key properties of 2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile?
2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile has a molecular weight of 1814.28 g/mol, XLogP of 32.89, 12 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile is sourced from PubChem (CID 160825245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).