6-(8-chloroquinolin-6-yl)-5-(cyclopentylmethylsulfinyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethylsulfinyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-ethylsulfonyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-(oxetan-3-ylmethylsulfonyl)-7-phenyl-1H-1,8-naphthyridin-2-one;N-[3-(8-chloroquinolin-6-yl)-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide;N-[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]-1-[6-(trifluoromethyl)-3-pyridinyl]methanesulfinamide

C161H118Cl6F3N21O15S6 — CID 159419637

IUPAC6-(8-chloroquinolin-6-yl)-5-(cyclopentylmethylsulfinyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethylsulfinyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-ethylsulfonyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-(oxetan-3-ylmethylsulfonyl)-7-phenyl-1H-1,8-naphthyridin-2-one;N-[3-(8-chloroquinolin-6-yl)-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide;N-[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]-1-[6-(trifluoromethyl)-3-pyridinyl]methanesulfinamide
SMILESCCS(=O)(=O)c1c(-c2cc(Cl)c3ncccc3c2)c(-c2ccccc2)nc2[nH]c(=O)ccc12.CCS(=O)Nc1c(-c2cc(Cl)c3ncccc3c2)c(-c2ccccc2)nc2[nH]c(=O)ccc12.CCS(=O)c1cc2cc(-c3cc(Cl)c4ncccc4c3)c(-c3ccccc3)nc2[nH]c1=O.O=c1[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)cc2cc1NS(=O)Cc1ccc(C(F)(F)F)nc1.O=c1[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)cc2cc1S(=O)(=O)CC1COC1.O=c1ccc2c(S(=O)CC3CCCC3)c(-c3cc(Cl)c4ncccc4c3)c(-c3ccccc3)nc2[nH]1
InChIInChI=1S/C30H19ClF3N5O2S.C29H24ClN3O2S.C27H20ClN3O4S.C25H19ClN4O2S.C25H18ClN3O3S.C25H18ClN3O2S/c31-23-13-20(11-19-7-4-10-35-27(19)23)22-12-21-14-24(29(40)38-28(21)37-26(22)18-5-2-1-3-6-18)39-42(41)16-17-8-9-25(36-15-17)30(32,33)34;30-23-16-21(15-20-11-6-14-31-26(20)23)25-27(19-9-2-1-3-10-19)33-29-22(12-13-24(34)32-29)28(25)36(35)17-18-7-4-5-8-18;28-22-11-19(9-18-7-4-8-29-25(18)22)21-10-20-12-23(36(33,34)15-16-13-35-14-16)27(32)31-26(20)30-24(21)17-5-2-1-3-6-17;1-2-33(32)30-24-18-10-11-20(31)28-25(18)29-23(15-7-4-3-5-8-15)21(24)17-13-16-9-6-12-27-22(16)19(26)14-17;1-2-33(31,32)24-18-10-11-20(30)28-25(18)29-23(15-7-4-3-5-8-15)21(24)17-13-16-9-6-12-27-22(16)19(26)14-17;1-2-32(31)21-14-18-12-19(17-11-16-9-6-10-27-23(16)20(26)13-17)22(15-7-4-3-5-8-15)28-24(18)29-25(21)30/h1-15,39H,16H2,(H,37,38,40);1-3,6,9-16,18H,4-5,7-8,17H2,(H,32,33,34);1-12,16H,13-15H2,(H,30,31,32);3-14H,2H2,1H3,(H2,28,29,30,31);3-14H,2H2,1H3,(H,28,29,30);3-14H,2H2,1H3,(H,28,29,30)
InChIKeyLPPHIITYMGVMFE-UHFFFAOYSA-N
MW3048.96 g/mol
LogP35.18
Rot. Bonds29

About 6-(8-chloroquinolin-6-yl)-5-(cyclopentylmethylsulfinyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethylsulfinyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-ethylsulfonyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-(oxetan-3-ylmethylsulfonyl)-7-phenyl-1H-1,8-naphthyridin-2-one;N-[3-(8-chloroquinolin-6-yl)-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide;N-[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]-1-[6-(trifluoromethyl)-3-pyridinyl]methanesulfinamide

6-(8-chloroquinolin-6-yl)-5-(cyclopentylmethylsulfinyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethylsulfinyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-ethylsulfonyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-(oxetan-3-ylmethylsulfonyl)-7-phenyl-1H-1,8-naphthyridin-2-one;N-[3-(8-chloroquinolin-6-yl)-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide;N-[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]-1-[6-(trifluoromethyl)-3-pyridinyl]methanesulfinamide (PubChem CID 159419637) has the molecular formula C161H118Cl6F3N21O15S6 and a molecular weight of 3048.96 g/mol. Its IUPAC name is 6-(8-chloroquinolin-6-yl)-5-(cyclopentylmethylsulfinyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethylsulfinyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-ethylsulfonyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-(oxetan-3-ylmethylsulfonyl)-7-phenyl-1H-1,8-naphthyridin-2-one;N-[3-(8-chloroquinolin-6-yl)-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide;N-[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]-1-[6-(trifluoromethyl)-3-pyridinyl]methanesulfinamide.

Molecular Properties

Compound Name6-(8-chloroquinolin-6-yl)-5-(cyclopentylmethylsulfinyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethylsulfinyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-ethylsulfonyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-(oxetan-3-ylmethylsulfonyl)-7-phenyl-1H-1,8-naphthyridin-2-one;N-[3-(8-chloroquinolin-6-yl)-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide;N-[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]-1-[6-(trifluoromethyl)-3-pyridinyl]methanesulfinamide
PubChem CID159419637
Molecular FormulaC161H118Cl6F3N21O15S6
Molecular Weight3048.96 g/mol
Exact Mass3043.55
IUPAC Name6-(8-chloroquinolin-6-yl)-5-(cyclopentylmethylsulfinyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethylsulfinyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-ethylsulfonyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-(oxetan-3-ylmethylsulfonyl)-7-phenyl-1H-1,8-naphthyridin-2-one;N-[3-(8-chloroquinolin-6-yl)-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide;N-[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]-1-[6-(trifluoromethyl)-3-pyridinyl]methanesulfinamide
SMILESCCS(=O)(=O)c1c(-c2cc(Cl)c3ncccc3c2)c(-c2ccccc2)nc2[nH]c(=O)ccc12.CCS(=O)Nc1c(-c2cc(Cl)c3ncccc3c2)c(-c2ccccc2)nc2[nH]c(=O)ccc12.CCS(=O)c1cc2cc(-c3cc(Cl)c4ncccc4c3)c(-c3ccccc3)nc2[nH]c1=O.O=c1[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)cc2cc1NS(=O)Cc1ccc(C(F)(F)F)nc1.O=c1[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)cc2cc1S(=O)(=O)CC1COC1.O=c1ccc2c(S(=O)CC3CCCC3)c(-c3cc(Cl)c4ncccc4c3)c(-c3ccccc3)nc2[nH]1
InChIInChI=1S/C30H19ClF3N5O2S.C29H24ClN3O2S.C27H20ClN3O4S.C25H19ClN4O2S.C25H18ClN3O3S.C25H18ClN3O2S/c31-23-13-20(11-19-7-4-10-35-27(19)23)22-12-21-14-24(29(40)38-28(21)37-26(22)18-5-2-1-3-6-18)39-42(41)16-17-8-9-25(36-15-17)30(32,33)34;30-23-16-21(15-20-11-6-14-31-26(20)23)25-27(19-9-2-1-3-10-19)33-29-22(12-13-24(34)32-29)28(25)36(35)17-18-7-4-5-8-18;28-22-11-19(9-18-7-4-8-29-25(18)22)21-10-20-12-23(36(33,34)15-16-13-35-14-16)27(32)31-26(20)30-24(21)17-5-2-1-3-6-17;1-2-33(32)30-24-18-10-11-20(31)28-25(18)29-23(15-7-4-3-5-8-15)21(24)17-13-16-9-6-12-27-22(16)19(26)14-17;1-2-33(31,32)24-18-10-11-20(30)28-25(18)29-23(15-7-4-3-5-8-15)21(24)17-13-16-9-6-12-27-22(16)19(26)14-17;1-2-32(31)21-14-18-12-19(17-11-16-9-6-10-27-23(16)20(26)13-17)22(15-7-4-3-5-8-15)28-24(18)29-25(21)30/h1-15,39H,16H2,(H,37,38,40);1-3,6,9-16,18H,4-5,7-8,17H2,(H,32,33,34);1-12,16H,13-15H2,(H,30,31,32);3-14H,2H2,1H3,(H2,28,29,30,31);3-14H,2H2,1H3,(H,28,29,30);3-14H,2H2,1H3,(H,28,29,30)
InChIKeyLPPHIITYMGVMFE-UHFFFAOYSA-N
XLogP35.18
TPSA534.58 Ų
H-Bond Donors8
H-Bond Acceptors28
Rotatable Bonds29
Heavy Atoms212
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003048.96
LogP ≤ 535.18
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1028

Analyze 6-(8-chloroquinolin-6-yl)-5-(cyclopentylmethylsulfinyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethylsulfinyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-ethylsulfonyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-(oxetan-3-ylmethylsulfonyl)-7-phenyl-1H-1,8-naphthyridin-2-one;N-[3-(8-chloroquinolin-6-yl)-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide;N-[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]-1-[6-(trifluoromethyl)-3-pyridinyl]methanesulfinamide with MolForge

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Related Compounds

7-[3-[8-chloro-6-[2-[4-[8-chloro-6-(4-cyclopentylsulfanyl-7-oxo-2-phenyl-8H-1,8-naphthyridin-3-yl)quinolin-3-yl]phenyl]-7-oxo-5-phenylsulfanyl-8H-1,8-naphthyridin-3-yl]quinolin-3-yl]phenyl]-6-(8-chloroquinolin-6-yl)-5-methyl-3-methylsulfanyl-1H-1,8-naphthyridin-2-one
CID 155170927
1-[7-[3-[8-chloro-6-[6-[(4-methylpiperazin-1-yl)methyl]-7-oxo-2-phenyl-8H-1,8-naphthyridin-3-yl]quinolin-3-yl]phenyl]-6-(8-chloroquinolin-6-yl)-2-oxo-1H-1,8-naphthyridin-3-yl]-N-(6-methyl-3-pyridinyl)methanesulfonamide
CID 155170932
N-[3-[8-chloro-3-[3-[3-[8-chloro-3-[3-[3-(8-chloroquinolin-6-yl)-6-(oxetan-3-ylmethylsulfonyl)-7-oxo-8H-1,8-naphthyridin-2-yl]phenyl]quinolin-6-yl]-4-ethylsulfonyl-7-oxo-8H-1,8-naphthyridin-2-yl]phenyl]quinolin-6-yl]-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide
CID 155170968
4-anilino-6-(8-chloroquinolin-6-yl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-(cyclopentylamino)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-cyclopentylsulfanyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethyl-5-methyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-methyl-3-methylsulfanyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-7-phenyl-4-phenylsulfanyl-1H-1,8-naphthyridin-2-one
CID 158843452
3-(benzenesulfonylmethyl)-6-(8-chloroquinolin-6-yl)-7-phenyl-1H-1,8-naphthyridin-2-one;3-[3-(benzenesulfonyl)-2-oxopropyl]-6-(8-chloroquinolin-6-yl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-(cyclopropylsulfonylmethyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-[(6-methyl-3-pyridinyl)methylsulfinylmethyl]-7-phenyl-1H-1,8-naphthyridin-2-one;N-[[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]methyl]-6-methylpyridine-3-sulfinamide;N-[[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]methyl]-6-methylpyridine-3-sulfonamide
CID 161421431

Frequently Asked Questions

What is the IUPAC name of 6-(8-chloroquinolin-6-yl)-5-(cyclopentylmethylsulfinyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethylsulfinyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-ethylsulfonyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-(oxetan-3-ylmethylsulfonyl)-7-phenyl-1H-1,8-naphthyridin-2-one;N-[3-(8-chloroquinolin-6-yl)-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide;N-[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]-1-[6-(trifluoromethyl)-3-pyridinyl]methanesulfinamide?
The IUPAC name of 6-(8-chloroquinolin-6-yl)-5-(cyclopentylmethylsulfinyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethylsulfinyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-ethylsulfonyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-(oxetan-3-ylmethylsulfonyl)-7-phenyl-1H-1,8-naphthyridin-2-one;N-[3-(8-chloroquinolin-6-yl)-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide;N-[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]-1-[6-(trifluoromethyl)-3-pyridinyl]methanesulfinamide (CID 159419637) is 6-(8-chloroquinolin-6-yl)-5-(cyclopentylmethylsulfinyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethylsulfinyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-ethylsulfonyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-(oxetan-3-ylmethylsulfonyl)-7-phenyl-1H-1,8-naphthyridin-2-one;N-[3-(8-chloroquinolin-6-yl)-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide;N-[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]-1-[6-(trifluoromethyl)-3-pyridinyl]methanesulfinamide.
What is the SMILES notation for 6-(8-chloroquinolin-6-yl)-5-(cyclopentylmethylsulfinyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethylsulfinyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-ethylsulfonyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-(oxetan-3-ylmethylsulfonyl)-7-phenyl-1H-1,8-naphthyridin-2-one;N-[3-(8-chloroquinolin-6-yl)-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide;N-[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]-1-[6-(trifluoromethyl)-3-pyridinyl]methanesulfinamide?
The canonical SMILES for 6-(8-chloroquinolin-6-yl)-5-(cyclopentylmethylsulfinyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethylsulfinyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-ethylsulfonyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-(oxetan-3-ylmethylsulfonyl)-7-phenyl-1H-1,8-naphthyridin-2-one;N-[3-(8-chloroquinolin-6-yl)-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide;N-[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]-1-[6-(trifluoromethyl)-3-pyridinyl]methanesulfinamide is CCS(=O)(=O)c1c(-c2cc(Cl)c3ncccc3c2)c(-c2ccccc2)nc2[nH]c(=O)ccc12.CCS(=O)Nc1c(-c2cc(Cl)c3ncccc3c2)c(-c2ccccc2)nc2[nH]c(=O)ccc12.CCS(=O)c1cc2cc(-c3cc(Cl)c4ncccc4c3)c(-c3ccccc3)nc2[nH]c1=O.O=c1[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)cc2cc1NS(=O)Cc1ccc(C(F)(F)F)nc1.O=c1[nH]c2nc(-c3ccccc3)c(-c3cc(Cl)c4ncccc4c3)cc2cc1S(=O)(=O)CC1COC1.O=c1ccc2c(S(=O)CC3CCCC3)c(-c3cc(Cl)c4ncccc4c3)c(-c3ccccc3)nc2[nH]1.
What is the InChIKey of 6-(8-chloroquinolin-6-yl)-5-(cyclopentylmethylsulfinyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethylsulfinyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-ethylsulfonyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-(oxetan-3-ylmethylsulfonyl)-7-phenyl-1H-1,8-naphthyridin-2-one;N-[3-(8-chloroquinolin-6-yl)-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide;N-[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]-1-[6-(trifluoromethyl)-3-pyridinyl]methanesulfinamide?
The InChIKey is LPPHIITYMGVMFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H19ClF3N5O2S.C29H24ClN3O2S.C27H20ClN3O4S.C25H19ClN4O2S.C25H18ClN3O3S.C25H18ClN3O2S/c31-23-13-20(11-19-7-4-10-35-27(19)23)22-12-21-14-24(29(40)38-28(21)37-26(22)18-5-2-1-3-6-18)39-42(41)16-17-8-9-25(36-15-17)30(32,33)34;30-23-16-21(15-20-11-6-14-31-26(20)23)25-27(19-9-2-1-3-10-19)33-29-22(12-13-24(34)32-29)28(25)36(35)17-18-7-4-5-8-18;28-22-11-19(9-18-7-4-8-29-25(18)22)21-10-20-12-23(36(33,34)15-16-13-35-14-16)27(32)31-26(20)30-24(21)17-5-2-1-3-6-17;1-2-33(32)30-24-18-10-11-20(31)28-25(18)29-23(15-7-4-3-5-8-15)21(24)17-13-16-9-6-12-27-22(16)19(26)14-17;1-2-33(31,32)24-18-10-11-20(30)28-25(18)29-23(15-7-4-3-5-8-15)21(24)17-13-16-9-6-12-27-22(16)19(26)14-17;1-2-32(31)21-14-18-12-19(17-11-16-9-6-10-27-23(16)20(26)13-17)22(15-7-4-3-5-8-15)28-24(18)29-25(21)30/h1-15,39H,16H2,(H,37,38,40);1-3,6,9-16,18H,4-5,7-8,17H2,(H,32,33,34);1-12,16H,13-15H2,(H,30,31,32);3-14H,2H2,1H3,(H2,28,29,30,31);3-14H,2H2,1H3,(H,28,29,30);3-14H,2H2,1H3,(H,28,29,30).
What are the key properties of 6-(8-chloroquinolin-6-yl)-5-(cyclopentylmethylsulfinyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethylsulfinyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-ethylsulfonyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-(oxetan-3-ylmethylsulfonyl)-7-phenyl-1H-1,8-naphthyridin-2-one;N-[3-(8-chloroquinolin-6-yl)-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide;N-[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]-1-[6-(trifluoromethyl)-3-pyridinyl]methanesulfinamide?
6-(8-chloroquinolin-6-yl)-5-(cyclopentylmethylsulfinyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethylsulfinyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-ethylsulfonyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-(oxetan-3-ylmethylsulfonyl)-7-phenyl-1H-1,8-naphthyridin-2-one;N-[3-(8-chloroquinolin-6-yl)-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide;N-[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]-1-[6-(trifluoromethyl)-3-pyridinyl]methanesulfinamide has a molecular weight of 3048.96 g/mol, XLogP of 35.18, 29 rotatable bonds, 8 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(8-chloroquinolin-6-yl)-5-(cyclopentylmethylsulfinyl)-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-ethylsulfinyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-5-ethylsulfonyl-7-phenyl-1H-1,8-naphthyridin-2-one;6-(8-chloroquinolin-6-yl)-3-(oxetan-3-ylmethylsulfonyl)-7-phenyl-1H-1,8-naphthyridin-2-one;N-[3-(8-chloroquinolin-6-yl)-7-oxo-2-phenyl-8H-1,8-naphthyridin-4-yl]ethanesulfinamide;N-[6-(8-chloroquinolin-6-yl)-2-oxo-7-phenyl-1H-1,8-naphthyridin-3-yl]-1-[6-(trifluoromethyl)-3-pyridinyl]methanesulfinamide is sourced from PubChem (CID 159419637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).