6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one

C163H116Cl6N26O6 — CID 158167248

IUPAC6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one
SMILESCN1CC(c2c(-c3cc(Cl)c4ncccc4c3)c(-c3ccccc3)nc3[nH]ccc(=O)c23)C1.CN1CCN(c2cc(=O)c3cc(-c4cc(Cl)c5ncccc5c4)c(-c4ccccc4)nc3[nH]2)CC1.O=c1c(-c2ccn[nH]2)c[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)cc12.O=c1c(N2CCCC2)c[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)cc12.O=c1cc(-c2cccnc2)[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)cc12.O=c1cc[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)c(-n3cccc3)c12
InChIInChI=1S/C28H24ClN5O.C28H17ClN4O.C27H21ClN4O.C27H17ClN4O.C27H21ClN4O.C26H16ClN5O/c1-33-10-12-34(13-11-33)25-17-24(35)22-16-21(20-14-19-8-5-9-30-27(19)23(29)15-20)26(32-28(22)31-25)18-6-3-2-4-7-18;29-23-13-20(12-18-8-5-11-31-27(18)23)21-14-22-25(34)15-24(19-9-4-10-30-16-19)32-28(22)33-26(21)17-6-2-1-3-7-17;1-32-14-19(15-32)22-23(18-12-17-8-5-10-29-25(17)20(28)13-18)26(16-6-3-2-4-7-16)31-27-24(22)21(33)9-11-30-27;28-20-16-19(15-18-9-6-11-29-24(18)20)22-25(17-7-2-1-3-8-17)31-27-23(21(33)10-12-30-27)26(22)32-13-4-5-14-32;28-22-14-19(13-18-9-6-10-29-25(18)22)20-15-21-26(33)23(32-11-4-5-12-32)16-30-27(21)31-24(20)17-7-2-1-3-8-17;27-21-12-17(11-16-7-4-9-28-24(16)21)18-13-19-25(33)20(22-8-10-30-32-22)14-29-26(19)31-23(18)15-5-2-1-3-6-15/h2-9,14-17H,10-13H2,1H3,(H,31,32,35);1-16H,(H,32,33,34);2-13,19H,14-15H2,1H3,(H,30,31,33);1-16H,(H,30,31,33);1-3,6-10,13-16H,4-5,11-12H2,(H,30,31,33);1-14H,(H,30,32)(H,29,31,33)
InChIKeyFWZOVKVRYIDZJU-UHFFFAOYSA-N
MW2747.61 g/mol
LogP35.38
Rot. Bonds18

About 6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one

6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one (PubChem CID 158167248) has the molecular formula C163H116Cl6N26O6 and a molecular weight of 2747.61 g/mol. Its IUPAC name is 6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one.

Molecular Properties

Compound Name6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one
PubChem CID158167248
Molecular FormulaC163H116Cl6N26O6
Molecular Weight2747.61 g/mol
Exact Mass2742.77
IUPAC Name6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one
SMILESCN1CC(c2c(-c3cc(Cl)c4ncccc4c3)c(-c3ccccc3)nc3[nH]ccc(=O)c23)C1.CN1CCN(c2cc(=O)c3cc(-c4cc(Cl)c5ncccc5c4)c(-c4ccccc4)nc3[nH]2)CC1.O=c1c(-c2ccn[nH]2)c[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)cc12.O=c1c(N2CCCC2)c[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)cc12.O=c1cc(-c2cccnc2)[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)cc12.O=c1cc[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)c(-n3cccc3)c12
InChIInChI=1S/C28H24ClN5O.C28H17ClN4O.C27H21ClN4O.C27H17ClN4O.C27H21ClN4O.C26H16ClN5O/c1-33-10-12-34(13-11-33)25-17-24(35)22-16-21(20-14-19-8-5-9-30-27(19)23(29)15-20)26(32-28(22)31-25)18-6-3-2-4-7-18;29-23-13-20(12-18-8-5-11-31-27(18)23)21-14-22-25(34)15-24(19-9-4-10-30-16-19)32-28(22)33-26(21)17-6-2-1-3-7-17;1-32-14-19(15-32)22-23(18-12-17-8-5-10-29-25(17)20(28)13-18)26(16-6-3-2-4-7-16)31-27-24(22)21(33)9-11-30-27;28-20-16-19(15-18-9-6-11-29-24(18)20)22-25(17-7-2-1-3-8-17)31-27-23(21(33)10-12-30-27)26(22)32-13-4-5-14-32;28-22-14-19(13-18-9-6-10-29-25(18)22)20-15-21-26(33)23(32-11-4-5-12-32)16-30-27(21)31-24(20)17-7-2-1-3-8-17;27-21-12-17(11-16-7-4-9-28-24(16)21)18-13-19-25(33)20(22-8-10-30-32-22)14-29-26(19)31-23(18)15-5-2-1-3-6-15/h2-9,14-17H,10-13H2,1H3,(H,31,32,35);1-16H,(H,32,33,34);2-13,19H,14-15H2,1H3,(H,30,31,33);1-16H,(H,30,31,33);1-3,6-10,13-16H,4-5,11-12H2,(H,30,31,33);1-14H,(H,30,32)(H,29,31,33)
InChIKeyFWZOVKVRYIDZJU-UHFFFAOYSA-N
XLogP35.38
TPSA411.30 Ų
H-Bond Donors7
H-Bond Acceptors25
Rotatable Bonds18
Heavy Atoms201
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002747.61
LogP ≤ 535.38
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1025

Analyze 6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one with MolForge

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Launch Full Analysis

Related Compounds

6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one
CID 137438313
7-[3-[8-chloro-6-(5-oxo-2-phenyl-6-pyrrolidin-1-yl-8H-1,8-naphthyridin-3-yl)quinolin-3-yl]phenyl]-6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-1H-1,8-naphthyridin-4-one
CID 155170955
6-[8-chloro-3-[3-[3-[2-chloro-6-[[3-[3-(2-chloro-6-methyl-4-pyridinyl)-7-[(3-methylpyrrol-1-yl)methyl]-5-oxo-8H-1,8-naphthyridin-2-yl]phenyl]methyl]-4-pyridinyl]-6-[(4-methylphenyl)methyl]-5-oxo-8H-1,8-naphthyridin-2-yl]phenyl]quinolin-6-yl]-3-methyl-7-phenyl-1H-1,8-naphthyridin-2-one
CID 155170992
7-[4-[[6-chloro-4-[2-[3-[[6-chloro-4-[5-oxo-2-phenyl-6-(1H-pyrazol-5-yl)-8H-1,8-naphthyridin-3-yl]-2-pyridinyl]methyl]phenyl]-5-oxo-7-pyridin-3-yl-8H-1,8-naphthyridin-3-yl]-2-pyridinyl]methyl]phenyl]-6-(2-chloro-6-methyl-4-pyridinyl)-5-(1-methylazetidin-3-yl)-1H-1,8-naphthyridin-4-one
CID 155171002
7-[4-[8-chloro-6-[6-[(4-methylphenyl)methyl]-5-oxo-2-phenyl-8H-1,8-naphthyridin-3-yl]quinolin-3-yl]phenyl]-6-(8-chloroquinolin-6-yl)-2-[(3-methylpyrrol-1-yl)methyl]-1H-1,8-naphthyridin-4-one
CID 155171009
6-(8-chloroquinolin-6-yl)-7-(2-methyl-1H-pyrazol-2-ium-5-yl)-1H-1,8-naphthyridin-4-one
CID 155621567
1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-3-[2-(diethylamino)ethyl]urea;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-3-(4-methylphenyl)urea;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-3-(6-methyl-3-pyridinyl)urea;N-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-1-methylpyrrole-3-carboxamide
CID 157312784
6-(8-chloro-4-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloro-2-methylquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloro-2-methylquinolin-6-yl)-7-(3-methylpyrazol-1-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloro-3-methylquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloro-5-methylquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloro-5-methylquinolin-6-yl)-7-phenyl-1H-1,8-naphthyridin-2-one
CID 157399566
6-(2-chloro-6-methyl-4-pyridinyl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-2-naphthalen-2-yl-7-phenyl-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one
CID 157544361
1-(2-amino-6-chloro-5-quinolin-6-yl-3-pyridinyl)ethanone;7-chloro-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one;7-(3-methylpyrazol-1-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one;5-methyl-2H-pyrrole
CID 158193576
6-(8-chloro-4-methylquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(8-fluoro-3-methylquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(8-fluoro-4-methylquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(8-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one;2-methoxy-7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one;4-oxo-7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridine-2-carbonitrile
CID 158332867
1-[6-amino-3-(7-chloro-1H-indazol-5-yl)pyrazin-2-yl]pyridin-2-one;3-amino-6-(8-chloroquinolin-6-yl)-5-(3-methyl-2-oxo-1-pyridinyl)pyrazine-2-carboxamide;3-amino-5-(1-methylpyrazol-3-yl)-6-(1-oxo-2H-isoquinolin-6-yl)pyrazine-2-carbonitrile;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-8-chloro-2H-isoquinolin-1-one;5-(8-chloroquinolin-6-yl)-6-(1-ethylpyrazol-3-yl)pyrazin-2-amine
CID 158600704

Frequently Asked Questions

What is the IUPAC name of 6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one?
The IUPAC name of 6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one (CID 158167248) is 6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one.
What is the SMILES notation for 6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one?
The canonical SMILES for 6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one is CN1CC(c2c(-c3cc(Cl)c4ncccc4c3)c(-c3ccccc3)nc3[nH]ccc(=O)c23)C1.CN1CCN(c2cc(=O)c3cc(-c4cc(Cl)c5ncccc5c4)c(-c4ccccc4)nc3[nH]2)CC1.O=c1c(-c2ccn[nH]2)c[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)cc12.O=c1c(N2CCCC2)c[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)cc12.O=c1cc(-c2cccnc2)[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)cc12.O=c1cc[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)c(-n3cccc3)c12.
What is the InChIKey of 6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one?
The InChIKey is FWZOVKVRYIDZJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24ClN5O.C28H17ClN4O.C27H21ClN4O.C27H17ClN4O.C27H21ClN4O.C26H16ClN5O/c1-33-10-12-34(13-11-33)25-17-24(35)22-16-21(20-14-19-8-5-9-30-27(19)23(29)15-20)26(32-28(22)31-25)18-6-3-2-4-7-18;29-23-13-20(12-18-8-5-11-31-27(18)23)21-14-22-25(34)15-24(19-9-4-10-30-16-19)32-28(22)33-26(21)17-6-2-1-3-7-17;1-32-14-19(15-32)22-23(18-12-17-8-5-10-29-25(17)20(28)13-18)26(16-6-3-2-4-7-16)31-27-24(22)21(33)9-11-30-27;28-20-16-19(15-18-9-6-11-29-24(18)20)22-25(17-7-2-1-3-8-17)31-27-23(21(33)10-12-30-27)26(22)32-13-4-5-14-32;28-22-14-19(13-18-9-6-10-29-25(18)22)20-15-21-26(33)23(32-11-4-5-12-32)16-30-27(21)31-24(20)17-7-2-1-3-8-17;27-21-12-17(11-16-7-4-9-28-24(16)21)18-13-19-25(33)20(22-8-10-30-32-22)14-29-26(19)31-23(18)15-5-2-1-3-6-15/h2-9,14-17H,10-13H2,1H3,(H,31,32,35);1-16H,(H,32,33,34);2-13,19H,14-15H2,1H3,(H,30,31,33);1-16H,(H,30,31,33);1-3,6-10,13-16H,4-5,11-12H2,(H,30,31,33);1-14H,(H,30,32)(H,29,31,33).
What are the key properties of 6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one?
6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one has a molecular weight of 2747.61 g/mol, XLogP of 35.38, 18 rotatable bonds, 7 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-2-(4-methylpiperazin-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-(1H-pyrazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-2-pyridin-3-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-3-pyrrolidin-1-yl-1H-1,8-naphthyridin-4-one;6-(8-chloroquinolin-6-yl)-7-phenyl-5-pyrrol-1-yl-1H-1,8-naphthyridin-4-one is sourced from PubChem (CID 158167248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).