N-(1-benzylpiperidin-4-yl)-7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;1-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-4-N,4-N-dimethylcyclohexane-1,4-diamine;4-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine;4-N-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine;4-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide

C98H137N21OS5 — CID 157099849

IUPACN-(1-benzylpiperidin-4-yl)-7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;1-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-4-N,4-N-dimethylcyclohexane-1,4-diamine;4-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine;4-N-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine;4-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide
SMILESCCC1CCc2c(sc3ncnc(N4CCN(C(N)=O)CC4)c23)C1.CCC1CCc2c(sc3ncnc(NC4CCC(N)CC4)c23)C1.CCC1CCc2c(sc3ncnc(NC4CCN(Cc5ccccc5)CC4)c23)C1.CN(C)C1CCC(Nc2ncnc3sc4c(c23)CC(C)(C)CC4)CC1.CNC1CCC(Nc2ncnc3sc4c(c23)CC(C)(C)CC4)CC1
InChIInChI=1S/C24H30N4S.C20H30N4S.C19H28N4S.C18H26N4S.C17H23N5OS/c1-2-17-8-9-20-21(14-17)29-24-22(20)23(25-16-26-24)27-19-10-12-28(13-11-19)15-18-6-4-3-5-7-18;1-20(2)10-9-16-15(11-20)17-18(21-12-22-19(17)25-16)23-13-5-7-14(8-6-13)24(3)4;1-19(2)9-8-15-14(10-19)16-17(21-11-22-18(16)24-15)23-13-6-4-12(20-3)5-7-13;1-2-11-3-8-14-15(9-11)23-18-16(14)17(20-10-21-18)22-13-6-4-12(19)5-7-13;1-2-11-3-4-12-13(9-11)24-16-14(12)15(19-10-20-16)21-5-7-22(8-6-21)17(18)23/h3-7,16-17,19H,2,8-15H2,1H3,(H,25,26,27);12-14H,5-11H2,1-4H3,(H,21,22,23);11-13,20H,4-10H2,1-3H3,(H,21,22,23);10-13H,2-9,19H2,1H3,(H,20,21,22);10-11H,2-9H2,1H3,(H2,18,23)
InChIKeyAFQFWDXRQHGTBW-UHFFFAOYSA-N
MW1785.65 g/mol
LogP20.22
Rot. Bonds16

About N-(1-benzylpiperidin-4-yl)-7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;1-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-4-N,4-N-dimethylcyclohexane-1,4-diamine;4-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine;4-N-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine;4-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide

N-(1-benzylpiperidin-4-yl)-7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;1-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-4-N,4-N-dimethylcyclohexane-1,4-diamine;4-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine;4-N-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine;4-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide (PubChem CID 157099849) has the molecular formula C98H137N21OS5 and a molecular weight of 1785.65 g/mol. Its IUPAC name is N-(1-benzylpiperidin-4-yl)-7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;1-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-4-N,4-N-dimethylcyclohexane-1,4-diamine;4-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine;4-N-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine;4-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-4-yl)-7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;1-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-4-N,4-N-dimethylcyclohexane-1,4-diamine;4-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine;4-N-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine;4-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide
PubChem CID157099849
Molecular FormulaC98H137N21OS5
Molecular Weight1785.65 g/mol
Exact Mass1783.99
IUPAC NameN-(1-benzylpiperidin-4-yl)-7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;1-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-4-N,4-N-dimethylcyclohexane-1,4-diamine;4-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine;4-N-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine;4-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide
SMILESCCC1CCc2c(sc3ncnc(N4CCN(C(N)=O)CC4)c23)C1.CCC1CCc2c(sc3ncnc(NC4CCC(N)CC4)c23)C1.CCC1CCc2c(sc3ncnc(NC4CCN(Cc5ccccc5)CC4)c23)C1.CN(C)C1CCC(Nc2ncnc3sc4c(c23)CC(C)(C)CC4)CC1.CNC1CCC(Nc2ncnc3sc4c(c23)CC(C)(C)CC4)CC1
InChIInChI=1S/C24H30N4S.C20H30N4S.C19H28N4S.C18H26N4S.C17H23N5OS/c1-2-17-8-9-20-21(14-17)29-24-22(20)23(25-16-26-24)27-19-10-12-28(13-11-19)15-18-6-4-3-5-7-18;1-20(2)10-9-16-15(11-20)17-18(21-12-22-19(17)25-16)23-13-5-7-14(8-6-13)24(3)4;1-19(2)9-8-15-14(10-19)16-17(21-11-22-18(16)24-15)23-13-6-4-12(20-3)5-7-13;1-2-11-3-8-14-15(9-11)23-18-16(14)17(20-10-21-18)22-13-6-4-12(19)5-7-13;1-2-11-3-4-12-13(9-11)24-16-14(12)15(19-10-20-16)21-5-7-22(8-6-21)17(18)23/h3-7,16-17,19H,2,8-15H2,1H3,(H,25,26,27);12-14H,5-11H2,1-4H3,(H,21,22,23);11-13,20H,4-10H2,1-3H3,(H,21,22,23);10-13H,2-9,19H2,1H3,(H,20,21,22);10-11H,2-9H2,1H3,(H2,18,23)
InChIKeyAFQFWDXRQHGTBW-UHFFFAOYSA-N
XLogP20.22
TPSA271.12 Ų
H-Bond Donors7
H-Bond Acceptors25
Rotatable Bonds16
Heavy Atoms125
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001785.65
LogP ≤ 520.22
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1025

Analyze N-(1-benzylpiperidin-4-yl)-7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;1-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-4-N,4-N-dimethylcyclohexane-1,4-diamine;4-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine;4-N-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine;4-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide with MolForge

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Related Compounds

4-[[1-(5-Phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]methyl]piperazin-2-one;5-phenyl-4-[4-[[3-(trifluoromethyl)piperidin-1-yl]methyl]piperidin-1-yl]thieno[2,3-d]pyrimidine
CID 89579472
2-[(2S)-1-methylpyrrolidin-2-yl]-N-[[1-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]methyl]ethanamine;5-phenyl-4-[4-[[4-(trifluoromethyl)piperidin-1-yl]methyl]piperidin-1-yl]thieno[2,3-d]pyrimidine
CID 89579673
2-(4-ethylphenyl)-1-[(1S,4S)-5-[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]-2,5-diazabicyclo[2.2.2]octan-2-yl]ethanone;bis(2-(3-ethylphenyl)-1-[4-[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl]ethanone);3-[4-[2-oxo-2-[4-[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl]ethyl]phenyl]pyrrolidin-2-one;2-(4-pentan-2-ylphenyl)-1-[4-[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl]ethanone
CID 157100140
tris(N-[1-[(4-methylphenyl)methyl]piperidin-4-yl]-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine);N-[1-[[4-[(4-methylpiperazin-1-yl)methyl]phenyl]methyl]piperidin-4-yl]-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine;N-[1-[(4-piperidin-1-ylphenyl)methyl]piperidin-4-yl]-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine
CID 158209374
N-[(3S,4S)-1-benzyl-3-(2-cyclopentylethyl)piperidin-4-yl]-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-amine;(3S,4S)-1-benzyl-3-N-[(1-methoxypyrrolidin-2-yl)methyl]-4-N-[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]piperidine-3,4-diamine;(3S,4S)-1-benzyl-3-N-(2-phenylethyl)-4-N-[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]piperidine-3,4-diamine;(3S,4S)-3-N,1-dibenzyl-4-N-[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]piperidine-3,4-diamine
CID 160194307
N-(1-benzylpiperidin-4-yl)-N-methyl-6-propylthieno[2,3-d]pyrimidin-4-amine;N-(1-benzylpiperidin-4-yl)-6-propylthieno[2,3-d]pyrimidin-4-amine;N-[1-[(4-methylphenyl)methyl]piperidin-4-yl]-6-propylthieno[2,3-d]pyrimidin-4-amine;6-(2,2,2-trifluoroethyl)-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]thieno[2,3-d]pyrimidin-4-amine
CID 160369943
N'-[1-(3-fluorophenyl)ethyl]-N-[6-(2-methylpropyl)thieno[2,3-d]pyrimidin-4-yl]propane-1,3-diamine;N'-[1-(3-fluorophenyl)ethyl]-N-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)propane-1,3-diamine;N-[(3-fluorophenyl)methyl]-N'-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)propane-1,3-diamine;methane;N-[1-[2,2,2-trifluoro-1-(3-fluorophenyl)ethyl]piperidin-4-yl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine
CID 160376599
4-[4-[(3-methylpyrrolidin-1-yl)methyl]piperidin-1-yl]-5-phenylthieno[2,3-d]pyrimidine;N-[[1-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]methyl]propan-1-amine
CID 89579361
N-methyl-N-[1-[[1-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]methyl]pyrrolidin-3-yl]acetamide;1-[[1-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]methyl]pyrrolidine-2-carboxamide
CID 89579608
1-methyl-4-[[1-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]methylamino]pyrrolidin-2-one;(3S)-1-[[1-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]methyl]piperidin-3-amine
CID 89579775
2-(1-methylpyrrolidin-2-yl)-N-[[1-(5-phenylthieno[2,3-d]pyrimidin-4-yl)azetidin-3-yl]methyl]ethanamine;5-phenyl-4-[4-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]piperidin-1-yl]thieno[2,3-d]pyrimidine
CID 89579801
N,N-dimethyl-1-[[1-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]methyl]piperidin-4-amine;N-[[1-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]methyl]cyclopropanamine
CID 89579880

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-4-yl)-7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;1-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-4-N,4-N-dimethylcyclohexane-1,4-diamine;4-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine;4-N-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine;4-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide?
The IUPAC name of N-(1-benzylpiperidin-4-yl)-7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;1-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-4-N,4-N-dimethylcyclohexane-1,4-diamine;4-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine;4-N-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine;4-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide (CID 157099849) is N-(1-benzylpiperidin-4-yl)-7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;1-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-4-N,4-N-dimethylcyclohexane-1,4-diamine;4-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine;4-N-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine;4-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide.
What is the SMILES notation for N-(1-benzylpiperidin-4-yl)-7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;1-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-4-N,4-N-dimethylcyclohexane-1,4-diamine;4-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine;4-N-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine;4-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide?
The canonical SMILES for N-(1-benzylpiperidin-4-yl)-7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;1-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-4-N,4-N-dimethylcyclohexane-1,4-diamine;4-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine;4-N-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine;4-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide is CCC1CCc2c(sc3ncnc(N4CCN(C(N)=O)CC4)c23)C1.CCC1CCc2c(sc3ncnc(NC4CCC(N)CC4)c23)C1.CCC1CCc2c(sc3ncnc(NC4CCN(Cc5ccccc5)CC4)c23)C1.CN(C)C1CCC(Nc2ncnc3sc4c(c23)CC(C)(C)CC4)CC1.CNC1CCC(Nc2ncnc3sc4c(c23)CC(C)(C)CC4)CC1.
What is the InChIKey of N-(1-benzylpiperidin-4-yl)-7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;1-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-4-N,4-N-dimethylcyclohexane-1,4-diamine;4-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine;4-N-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine;4-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide?
The InChIKey is AFQFWDXRQHGTBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N4S.C20H30N4S.C19H28N4S.C18H26N4S.C17H23N5OS/c1-2-17-8-9-20-21(14-17)29-24-22(20)23(25-16-26-24)27-19-10-12-28(13-11-19)15-18-6-4-3-5-7-18;1-20(2)10-9-16-15(11-20)17-18(21-12-22-19(17)25-16)23-13-5-7-14(8-6-13)24(3)4;1-19(2)9-8-15-14(10-19)16-17(21-11-22-18(16)24-15)23-13-6-4-12(20-3)5-7-13;1-2-11-3-8-14-15(9-11)23-18-16(14)17(20-10-21-18)22-13-6-4-12(19)5-7-13;1-2-11-3-4-12-13(9-11)24-16-14(12)15(19-10-20-16)21-5-7-22(8-6-21)17(18)23/h3-7,16-17,19H,2,8-15H2,1H3,(H,25,26,27);12-14H,5-11H2,1-4H3,(H,21,22,23);11-13,20H,4-10H2,1-3H3,(H,21,22,23);10-13H,2-9,19H2,1H3,(H,20,21,22);10-11H,2-9H2,1H3,(H2,18,23).
What are the key properties of N-(1-benzylpiperidin-4-yl)-7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;1-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-4-N,4-N-dimethylcyclohexane-1,4-diamine;4-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine;4-N-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine;4-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide?
N-(1-benzylpiperidin-4-yl)-7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;1-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-4-N,4-N-dimethylcyclohexane-1,4-diamine;4-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine;4-N-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine;4-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide has a molecular weight of 1785.65 g/mol, XLogP of 20.22, 16 rotatable bonds, 7 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-4-yl)-7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;1-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-4-N,4-N-dimethylcyclohexane-1,4-diamine;4-N-(6,6-dimethyl-7,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine;4-N-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine;4-(7-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide is sourced from PubChem (CID 157099849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).