2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-octadecoxyethoxy(pyridin-3-ylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(9-[2-[[[[(2R)-1-ethoxypropan-2-yl]amino]-phenylmethoxyphosphoryl]methoxy]ethyl]-6-methoxypurin-2-amine);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine

C149H209N38O36P7 — CID 159458881

IUPAC2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-octadecoxyethoxy(pyridin-3-ylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(9-[2-[[[[(2R)-1-ethoxypropan-2-yl]amino]-phenylmethoxyphosphoryl]methoxy]ethyl]-6-methoxypurin-2-amine);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine
SMILESCC(=O)COP(=O)(COCCn1cnc2c(=O)[nH]c(N)nc21)OCc1ccccc1.CCCCCCCCCCCCCCCCCCOCCOP(=O)(COCCn1cnc2c(=O)[nH]c(N)nc21)OCc1cccnc1.CCOC[C@@H](C)NP(=O)(COCCn1cnc2c(OC)nc(N)nc21)OCc1ccccc1.CCOC[C@@H](C)NP(=O)(COCCn1cnc2c(OC)nc(N)nc21)OCc1ccccc1.COc1nc(N)nc2c1ncn2CCOCP(=O)(OCc1ccccc1)OCc1ccc(C)o1.COc1nc(N)nc2c1ncn2CCOCP(C)(=O)OCc1ccccc1.CP(=O)(COCCn1cnc2c(=O)[nH]c(N)nc21)OCc1ccccc1
InChIInChI=1S/C34H57N6O6P.C22H26N5O6P.2C21H31N6O5P.C18H22N5O6P.C17H22N5O4P.C16H20N5O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-43-24-25-45-47(42,46-27-30-19-18-20-36-26-30)29-44-23-21-40-28-37-31-32(40)38-34(35)39-33(31)41;1-16-8-9-18(33-16)13-32-34(28,31-12-17-6-4-3-5-7-17)15-30-11-10-27-14-24-19-20(27)25-22(23)26-21(19)29-2;2*1-4-30-12-16(2)26-33(28,32-13-17-8-6-5-7-9-17)15-31-11-10-27-14-23-18-19(27)24-21(22)25-20(18)29-3;1-13(24)9-28-30(26,29-10-14-5-3-2-4-6-14)12-27-8-7-23-11-20-15-16(23)21-18(19)22-17(15)25;1-24-16-14-15(20-17(18)21-16)22(11-19-14)8-9-25-12-27(2,23)26-10-13-6-4-3-5-7-13;1-26(23,25-9-12-5-3-2-4-6-12)11-24-8-7-21-10-18-13-14(21)19-16(17)20-15(13)22/h18-20,26,28H,2-17,21-25,27,29H2,1H3,(H3,35,38,39,41);3-9,14H,10-13,15H2,1-2H3,(H2,23,25,26);2*5-9,14,16H,4,10-13,15H2,1-3H3,(H,26,28)(H2,22,24,25);2-6,11H,7-10,12H2,1H3,(H3,19,21,22,25);3-7,11H,8-10,12H2,1-2H3,(H2,18,20,21);2-6,10H,7-9,11H2,1H3,(H3,17,19,20,22)/t;;2*16-,33?;;;/m..11.../s1
InChIKeyLUIIMLSNFCWSGG-GTGBPVRRSA-N
MW3325.36 g/mol
LogP23.33
Rot. Bonds97

About 2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-octadecoxyethoxy(pyridin-3-ylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(9-[2-[[[[(2R)-1-ethoxypropan-2-yl]amino]-phenylmethoxyphosphoryl]methoxy]ethyl]-6-methoxypurin-2-amine);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine

2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-octadecoxyethoxy(pyridin-3-ylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(9-[2-[[[[(2R)-1-ethoxypropan-2-yl]amino]-phenylmethoxyphosphoryl]methoxy]ethyl]-6-methoxypurin-2-amine);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine (PubChem CID 159458881) has the molecular formula C149H209N38O36P7 and a molecular weight of 3325.36 g/mol. Its IUPAC name is 2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-octadecoxyethoxy(pyridin-3-ylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(9-[2-[[[[(2R)-1-ethoxypropan-2-yl]amino]-phenylmethoxyphosphoryl]methoxy]ethyl]-6-methoxypurin-2-amine);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine.

Molecular Properties

Compound Name2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-octadecoxyethoxy(pyridin-3-ylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(9-[2-[[[[(2R)-1-ethoxypropan-2-yl]amino]-phenylmethoxyphosphoryl]methoxy]ethyl]-6-methoxypurin-2-amine);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine
PubChem CID159458881
Molecular FormulaC149H209N38O36P7
Molecular Weight3325.36 g/mol
Exact Mass3323.39
IUPAC Name2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-octadecoxyethoxy(pyridin-3-ylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(9-[2-[[[[(2R)-1-ethoxypropan-2-yl]amino]-phenylmethoxyphosphoryl]methoxy]ethyl]-6-methoxypurin-2-amine);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine
SMILESCC(=O)COP(=O)(COCCn1cnc2c(=O)[nH]c(N)nc21)OCc1ccccc1.CCCCCCCCCCCCCCCCCCOCCOP(=O)(COCCn1cnc2c(=O)[nH]c(N)nc21)OCc1cccnc1.CCOC[C@@H](C)NP(=O)(COCCn1cnc2c(OC)nc(N)nc21)OCc1ccccc1.CCOC[C@@H](C)NP(=O)(COCCn1cnc2c(OC)nc(N)nc21)OCc1ccccc1.COc1nc(N)nc2c1ncn2CCOCP(=O)(OCc1ccccc1)OCc1ccc(C)o1.COc1nc(N)nc2c1ncn2CCOCP(C)(=O)OCc1ccccc1.CP(=O)(COCCn1cnc2c(=O)[nH]c(N)nc21)OCc1ccccc1
InChIInChI=1S/C34H57N6O6P.C22H26N5O6P.2C21H31N6O5P.C18H22N5O6P.C17H22N5O4P.C16H20N5O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-43-24-25-45-47(42,46-27-30-19-18-20-36-26-30)29-44-23-21-40-28-37-31-32(40)38-34(35)39-33(31)41;1-16-8-9-18(33-16)13-32-34(28,31-12-17-6-4-3-5-7-17)15-30-11-10-27-14-24-19-20(27)25-22(23)26-21(19)29-2;2*1-4-30-12-16(2)26-33(28,32-13-17-8-6-5-7-9-17)15-31-11-10-27-14-23-18-19(27)24-21(22)25-20(18)29-3;1-13(24)9-28-30(26,29-10-14-5-3-2-4-6-14)12-27-8-7-23-11-20-15-16(23)21-18(19)22-17(15)25;1-24-16-14-15(20-17(18)21-16)22(11-19-14)8-9-25-12-27(2,23)26-10-13-6-4-3-5-7-13;1-26(23,25-9-12-5-3-2-4-6-12)11-24-8-7-21-10-18-13-14(21)19-16(17)20-15(13)22/h18-20,26,28H,2-17,21-25,27,29H2,1H3,(H3,35,38,39,41);3-9,14H,10-13,15H2,1-2H3,(H2,23,25,26);2*5-9,14,16H,4,10-13,15H2,1-3H3,(H,26,28)(H2,22,24,25);2-6,11H,7-10,12H2,1H3,(H3,19,21,22,25);3-7,11H,8-10,12H2,1-2H3,(H2,18,20,21);2-6,10H,7-9,11H2,1H3,(H3,17,19,20,22)/t;;2*16-,33?;;;/m..11.../s1
InChIKeyLUIIMLSNFCWSGG-GTGBPVRRSA-N
XLogP23.33
TPSA955.42 Ų
H-Bond Donors12
H-Bond Acceptors69
Rotatable Bonds97
Heavy Atoms230
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003325.36
LogP ≤ 523.33
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1069

Computed Properties (RDKit)

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

Analyze 2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-octadecoxyethoxy(pyridin-3-ylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(9-[2-[[[[(2R)-1-ethoxypropan-2-yl]amino]-phenylmethoxyphosphoryl]methoxy]ethyl]-6-methoxypurin-2-amine);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;ethyl (2R)-2-[[2-(2-amino-6-methoxypurin-9-yl)ethoxymethyl-phenylmethoxyphosphoryl]amino]propanoate;ethyl (2S)-2-[[2-(2-amino-6-methoxypurin-9-yl)ethoxymethyl-phenylmethoxyphosphoryl]amino]propanoate;6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine
CID 157346427
CID 157670335
CID 157670335
1-[4-[2-[[2-[4-[3-(Diethylamino)propoxy]phenyl]-[1,3]oxazolo[5,4-d]pyrimidin-7-yl]amino]ethyl]phenyl]-3-phenylurea;1-[4-[2-[[2-[4-[3-(diethylamino)propylamino]phenyl]-[1,3]oxazolo[5,4-d]pyrimidin-7-yl]amino]ethyl]phenyl]-3-phenylurea;1-[4-[2-[[2-[4-[3-[ethyl(2-hydroxyethyl)amino]propoxy]phenyl]-[1,3]oxazolo[5,4-d]pyrimidin-7-yl]amino]ethyl]phenyl]-3-phenylurea;2-[ethyl-[3-[4-[7-[2-[4-(phenylcarbamoylamino)phenyl]ethylamino]-[1,3]oxazolo[5,4-d]pyrimidin-2-yl]phenoxy]propyl]amino]ethyl dihydrogen phosphate
CID 157931578
2-phenyl-3-propan-2-ylpyridine;2-phenyl-5-propan-2-ylpyridine;2-phenyl-6-propan-2-ylpyridine;3-phenyl-2-propan-2-ylpyridine;3-phenyl-5-propan-2-ylpyridine;4-phenyl-2-propan-2-ylpyridine;4-phenyl-3-propan-2-ylpyridine;5-phenyl-2-propan-2-ylpyridine;6-propan-2-ylfuro[2,3-b]pyridine;6-propan-2-ylfuro[3,2-b]pyridine;5-propan-2-yl-1H-imidazo[4,5-b]pyridine;6-propan-2-yl-1H-imidazo[4,5-b]pyridine;5-propan-2-yl-[1,3]oxazolo[5,4-b]pyridine;6-propan-2-yl-[1,3]oxazolo[4,5-b]pyridine;6-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;6-propan-2-yl-1H-pyrrolo[3,2-b]pyridine
CID 158232279
2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(ethyl (2R)-2-[[2-(2-amino-6-methoxypurin-9-yl)ethoxymethyl-phenylmethoxyphosphoryl]amino]propanoate);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine
CID 158422295
2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-4,5-dihydro-1H-purin-6-one;2-amino-9-[2-[[2-oxobutoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;ethyl (2R)-2-[[2-(2-amino-6-methoxypurin-9-yl)ethoxymethyl-phenylmethoxyphosphoryl]amino]propanoate;ethyl (2S)-2-[[2-(2-amino-6-methoxypurin-9-yl)ethoxymethyl-phenylmethoxyphosphoryl]amino]propanoate;6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine
CID 158609158
[[5-(3-Carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] [3,4-dihydroxy-5-[6-[2-[4-(5-methylphenazin-5-ium-1-yl)oxybutanoylamino]ethylamino]purin-9-yl]oxolan-2-yl]methyl phosphate;[[5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] [5-[6-[2-[4-(5-ethylphenazin-5-ium-1-yl)oxybutanoylamino]ethylamino]purin-9-yl]-3,4-dihydroxyoxolan-2-yl]methyl phosphate;[[5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] [5-[6-[2-[4-(5-ethylphenazin-5-ium-1-yl)oxybutanoylamino]ethylamino]purin-9-yl]-3-hydroxy-4-phosphonooxyoxolan-2-yl]methyl phosphate;[[5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] [3-hydroxy-5-[6-[2-[4-(5-methylphenazin-5-ium-1-yl)oxybutanoylamino]ethylamino]purin-9-yl]-4-phosphonooxyoxolan-2-yl]methyl phosphate
CID 158917672
2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;ethyl (2R)-2-[[2-(2-amino-6-methoxypurin-9-yl)ethoxymethyl-phenylmethoxyphosphoryl]amino]propanoate;ethyl (2S)-2-[[2-(2-amino-6-methoxypurin-9-yl)ethoxymethyl-phenylmethoxyphosphoryl]amino]propanoate;6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine
CID 158934172
N-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 159070844
(3R)-3-[[2-(2-amino-6-methoxypurin-9-yl)ethoxymethyl-phenylmethoxyphosphoryl]amino]butan-2-one;(3S)-3-[[2-(2-amino-6-methoxypurin-9-yl)ethoxymethyl-phenylmethoxyphosphoryl]amino]butan-2-one;2-amino-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine
CID 159426939
2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[2-[2-oxopropoxy(phenylmethoxy)phosphoryl]ethoxy]ethyl]-1H-purin-6-one;ethyl 2-[[2-(2-amino-6-methoxypurin-9-yl)ethoxymethyl-phenylmethoxyphosphoryl]amino]-2-methylpropanoate;ethyl (2R)-2-[[2-(2-amino-6-methoxypurin-9-yl)ethoxymethyl-phenylmethoxyphosphoryl]amino]propanoate;6-methoxy-9-[2-[[(5-methylfuran-2-yl)oxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine
CID 159792425
[(2S,6R)-2,6-dimethylmorpholin-4-yl]-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
CID 160075206

Frequently Asked Questions

What is the IUPAC name of 2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-octadecoxyethoxy(pyridin-3-ylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(9-[2-[[[[(2R)-1-ethoxypropan-2-yl]amino]-phenylmethoxyphosphoryl]methoxy]ethyl]-6-methoxypurin-2-amine);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine?
The IUPAC name of 2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-octadecoxyethoxy(pyridin-3-ylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(9-[2-[[[[(2R)-1-ethoxypropan-2-yl]amino]-phenylmethoxyphosphoryl]methoxy]ethyl]-6-methoxypurin-2-amine);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine (CID 159458881) is 2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-octadecoxyethoxy(pyridin-3-ylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(9-[2-[[[[(2R)-1-ethoxypropan-2-yl]amino]-phenylmethoxyphosphoryl]methoxy]ethyl]-6-methoxypurin-2-amine);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine.
What is the SMILES notation for 2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-octadecoxyethoxy(pyridin-3-ylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(9-[2-[[[[(2R)-1-ethoxypropan-2-yl]amino]-phenylmethoxyphosphoryl]methoxy]ethyl]-6-methoxypurin-2-amine);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine?
The canonical SMILES for 2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-octadecoxyethoxy(pyridin-3-ylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(9-[2-[[[[(2R)-1-ethoxypropan-2-yl]amino]-phenylmethoxyphosphoryl]methoxy]ethyl]-6-methoxypurin-2-amine);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine is CC(=O)COP(=O)(COCCn1cnc2c(=O)[nH]c(N)nc21)OCc1ccccc1.CCCCCCCCCCCCCCCCCCOCCOP(=O)(COCCn1cnc2c(=O)[nH]c(N)nc21)OCc1cccnc1.CCOC[C@@H](C)NP(=O)(COCCn1cnc2c(OC)nc(N)nc21)OCc1ccccc1.CCOC[C@@H](C)NP(=O)(COCCn1cnc2c(OC)nc(N)nc21)OCc1ccccc1.COc1nc(N)nc2c1ncn2CCOCP(=O)(OCc1ccccc1)OCc1ccc(C)o1.COc1nc(N)nc2c1ncn2CCOCP(C)(=O)OCc1ccccc1.CP(=O)(COCCn1cnc2c(=O)[nH]c(N)nc21)OCc1ccccc1.
What is the InChIKey of 2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-octadecoxyethoxy(pyridin-3-ylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(9-[2-[[[[(2R)-1-ethoxypropan-2-yl]amino]-phenylmethoxyphosphoryl]methoxy]ethyl]-6-methoxypurin-2-amine);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine?
The InChIKey is LUIIMLSNFCWSGG-GTGBPVRRSA-N. The full InChI is InChI=1S/C34H57N6O6P.C22H26N5O6P.2C21H31N6O5P.C18H22N5O6P.C17H22N5O4P.C16H20N5O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-43-24-25-45-47(42,46-27-30-19-18-20-36-26-30)29-44-23-21-40-28-37-31-32(40)38-34(35)39-33(31)41;1-16-8-9-18(33-16)13-32-34(28,31-12-17-6-4-3-5-7-17)15-30-11-10-27-14-24-19-20(27)25-22(23)26-21(19)29-2;2*1-4-30-12-16(2)26-33(28,32-13-17-8-6-5-7-9-17)15-31-11-10-27-14-23-18-19(27)24-21(22)25-20(18)29-3;1-13(24)9-28-30(26,29-10-14-5-3-2-4-6-14)12-27-8-7-23-11-20-15-16(23)21-18(19)22-17(15)25;1-24-16-14-15(20-17(18)21-16)22(11-19-14)8-9-25-12-27(2,23)26-10-13-6-4-3-5-7-13;1-26(23,25-9-12-5-3-2-4-6-12)11-24-8-7-21-10-18-13-14(21)19-16(17)20-15(13)22/h18-20,26,28H,2-17,21-25,27,29H2,1H3,(H3,35,38,39,41);3-9,14H,10-13,15H2,1-2H3,(H2,23,25,26);2*5-9,14,16H,4,10-13,15H2,1-3H3,(H,26,28)(H2,22,24,25);2-6,11H,7-10,12H2,1H3,(H3,19,21,22,25);3-7,11H,8-10,12H2,1-2H3,(H2,18,20,21);2-6,10H,7-9,11H2,1H3,(H3,17,19,20,22)/t;;2*16-,33?;;;/m..11.../s1.
What are the key properties of 2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-octadecoxyethoxy(pyridin-3-ylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(9-[2-[[[[(2R)-1-ethoxypropan-2-yl]amino]-phenylmethoxyphosphoryl]methoxy]ethyl]-6-methoxypurin-2-amine);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine?
2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-octadecoxyethoxy(pyridin-3-ylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(9-[2-[[[[(2R)-1-ethoxypropan-2-yl]amino]-phenylmethoxyphosphoryl]methoxy]ethyl]-6-methoxypurin-2-amine);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine has a molecular weight of 3325.36 g/mol, XLogP of 23.33, 97 rotatable bonds, 12 hydrogen bond donors, and 69 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-octadecoxyethoxy(pyridin-3-ylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;2-amino-9-[2-[[2-oxopropoxy(phenylmethoxy)phosphoryl]methoxy]ethyl]-1H-purin-6-one;bis(9-[2-[[[[(2R)-1-ethoxypropan-2-yl]amino]-phenylmethoxyphosphoryl]methoxy]ethyl]-6-methoxypurin-2-amine);6-methoxy-9-[2-[[(5-methylfuran-2-yl)methoxy-phenylmethoxyphosphoryl]methoxy]ethyl]purin-2-amine;6-methoxy-9-[2-[[methyl(phenylmethoxy)phosphoryl]methoxy]ethyl]purin-2-amine is sourced from PubChem (CID 159458881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).