4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine

C102H97Br6N27O14S3 — CID 162089417

IUPAC4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCN1CCOc2cc(-c3cnn4c(N)c(Br)c(N5CCS(=O)(=O)CC5)nc34)cnc21.Cc1ccc2ncc(-c3cnn4c(N)c(Br)c(N5CCS(=O)(=O)CC5)nc34)cc2c1.Nc1c(Br)c(N2CCS(=O)(=O)CC2)nc2c(-c3ccc4nocc4c3Br)cnn12.Nc1c(Br)c(OC2CCC(C(=O)O)CC2)nc2c(-c3ccc4ccccc4c3)cnn12.Nc1c(Br)c(OCC2CCC(C(=O)O)CC2)nc2c(-c3ccc4ccccc4c3)cnn12
InChIInChI=1S/C24H23BrN4O3.C23H21BrN4O3.C20H19BrN6O2S.C18H20BrN7O3S.C17H14Br2N6O3S/c25-20-21(26)29-22(28-23(20)32-13-14-5-7-16(8-6-14)24(30)31)19(12-27-29)18-10-9-15-3-1-2-4-17(15)11-18;24-19-20(25)28-21(27-22(19)31-17-9-7-14(8-10-17)23(29)30)18(12-26-28)16-6-5-13-3-1-2-4-15(13)11-16;1-12-2-3-16-13(8-12)9-14(10-23-16)15-11-24-27-18(22)17(21)20(25-19(15)27)26-4-6-30(28,29)7-5-26;1-24-2-5-29-13-8-11(9-21-17(13)24)12-10-22-26-15(20)14(19)18(23-16(12)26)25-3-6-30(27,28)7-4-25;18-13-9(1-2-12-11(13)8-28-23-12)10-7-21-25-15(20)14(19)17(22-16(10)25)24-3-5-29(26,27)6-4-24/h1-4,9-12,14,16H,5-8,13,26H2,(H,30,31);1-6,11-12,14,17H,7-10,25H2,(H,29,30);2-3,8-11H,4-7,22H2,1H3;8-10H,2-7,20H2,1H3;1-2,7-8H,3-6,20H2
InChIKeyZDKBCUDLGVUCDF-UHFFFAOYSA-N
MW2500.70 g/mol
LogP16.99
Rot. Bonds15

About 4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine

4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 162089417) has the molecular formula C102H97Br6N27O14S3 and a molecular weight of 2500.70 g/mol. Its IUPAC name is 4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID162089417
Molecular FormulaC102H97Br6N27O14S3
Molecular Weight2500.70 g/mol
Exact Mass2493.20
IUPAC Name4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCN1CCOc2cc(-c3cnn4c(N)c(Br)c(N5CCS(=O)(=O)CC5)nc34)cnc21.Cc1ccc2ncc(-c3cnn4c(N)c(Br)c(N5CCS(=O)(=O)CC5)nc34)cc2c1.Nc1c(Br)c(N2CCS(=O)(=O)CC2)nc2c(-c3ccc4nocc4c3Br)cnn12.Nc1c(Br)c(OC2CCC(C(=O)O)CC2)nc2c(-c3ccc4ccccc4c3)cnn12.Nc1c(Br)c(OCC2CCC(C(=O)O)CC2)nc2c(-c3ccc4ccccc4c3)cnn12
InChIInChI=1S/C24H23BrN4O3.C23H21BrN4O3.C20H19BrN6O2S.C18H20BrN7O3S.C17H14Br2N6O3S/c25-20-21(26)29-22(28-23(20)32-13-14-5-7-16(8-6-14)24(30)31)19(12-27-29)18-10-9-15-3-1-2-4-17(15)11-18;24-19-20(25)28-21(27-22(19)31-17-9-7-14(8-10-17)23(29)30)18(12-26-28)16-6-5-13-3-1-2-4-15(13)11-16;1-12-2-3-16-13(8-12)9-14(10-23-16)15-11-24-27-18(22)17(21)20(25-19(15)27)26-4-6-30(28,29)7-5-26;1-24-2-5-29-13-8-11(9-21-17(13)24)12-10-22-26-15(20)14(19)18(23-16(12)26)25-3-6-30(27,28)7-4-25;18-13-9(1-2-12-11(13)8-28-23-12)10-7-21-25-15(20)14(19)17(22-16(10)25)24-3-5-29(26,27)6-4-24/h1-4,9-12,14,16H,5-8,13,26H2,(H,30,31);1-6,11-12,14,17H,7-10,25H2,(H,29,30);2-3,8-11H,4-7,22H2,1H3;8-10H,2-7,20H2,1H3;1-2,7-8H,3-6,20H2
InChIKeyZDKBCUDLGVUCDF-UHFFFAOYSA-N
XLogP16.99
TPSA550.53 Ų
H-Bond Donors7
H-Bond Acceptors39
Rotatable Bonds15
Heavy Atoms152
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002500.70
LogP ≤ 516.99
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1039

Analyze 4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine with MolForge

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Related Compounds

2-[4-[7-amino-6-bromo-3-(6-bromonaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]cyclohexyl]-N-methylsulfonylacetamide;2-[4-[7-amino-6-bromo-3-(5-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]cyclohexyl]acetic acid;2-[4-[7-amino-6-bromo-3-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]cyclohexyl]acetic acid;2-[4-[7-amino-6-bromo-3-(7-methylisoquinolin-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]cyclohexyl]acetic acid;6-bromo-5-(1-methylsulfonylpyrrolidin-3-yl)-3-quinolin-6-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 158764283
2-[4-[7-amino-6-bromo-3-(5-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]cyclohexyl]acetic acid;2-[4-[7-amino-6-bromo-3-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]cyclohexyl]acetic acid;2-[4-[7-amino-6-bromo-3-(6-methylnaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]cyclohexyl]-N-methylsulfonylacetamide;2-[4-[7-amino-6-bromo-3-(7-methylquinolin-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]cyclohexyl]acetic acid;6-bromo-5-(1-methylsulfonylpyrrolidin-3-yl)-3-quinolin-6-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 159362713
4-(7-Amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxypiperidine-1-carbaldehyde;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 160879435
4-[6-Acetyl-7-amino-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-5-yl]oxybenzoic acid;4-[6-acetyl-7-amino-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]oxybenzoic acid;6-bromo-5-[(4-methylsulfonylphenyl)methyl]-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-[(4-methylsulfonylphenyl)methyl]-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-[(4-methylsulfonylphenyl)methyl]-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 161196780
3-(1-Benzothiophen-3-yl)-6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(2,1-benzoxazol-5-yl)-6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(2-bromo-1-benzothiophen-3-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(1-methylpyrrol-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 162141932

Frequently Asked Questions

What is the IUPAC name of 4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 162089417) is 4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine is CN1CCOc2cc(-c3cnn4c(N)c(Br)c(N5CCS(=O)(=O)CC5)nc34)cnc21.Cc1ccc2ncc(-c3cnn4c(N)c(Br)c(N5CCS(=O)(=O)CC5)nc34)cc2c1.Nc1c(Br)c(N2CCS(=O)(=O)CC2)nc2c(-c3ccc4nocc4c3Br)cnn12.Nc1c(Br)c(OC2CCC(C(=O)O)CC2)nc2c(-c3ccc4ccccc4c3)cnn12.Nc1c(Br)c(OCC2CCC(C(=O)O)CC2)nc2c(-c3ccc4ccccc4c3)cnn12.
What is the InChIKey of 4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is ZDKBCUDLGVUCDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23BrN4O3.C23H21BrN4O3.C20H19BrN6O2S.C18H20BrN7O3S.C17H14Br2N6O3S/c25-20-21(26)29-22(28-23(20)32-13-14-5-7-16(8-6-14)24(30)31)19(12-27-29)18-10-9-15-3-1-2-4-17(15)11-18;24-19-20(25)28-21(27-22(19)31-17-9-7-14(8-10-17)23(29)30)18(12-26-28)16-6-5-13-3-1-2-4-15(13)11-16;1-12-2-3-16-13(8-12)9-14(10-23-16)15-11-24-27-18(22)17(21)20(25-19(15)27)26-4-6-30(28,29)7-5-26;1-24-2-5-29-13-8-11(9-21-17(13)24)12-10-22-26-15(20)14(19)18(23-16(12)26)25-3-6-30(27,28)7-4-25;18-13-9(1-2-12-11(13)8-28-23-12)10-7-21-25-15(20)14(19)17(22-16(10)25)24-3-5-29(26,27)6-4-24/h1-4,9-12,14,16H,5-8,13,26H2,(H,30,31);1-6,11-12,14,17H,7-10,25H2,(H,29,30);2-3,8-11H,4-7,22H2,1H3;8-10H,2-7,20H2,1H3;1-2,7-8H,3-6,20H2.
What are the key properties of 4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 2500.70 g/mol, XLogP of 16.99, 15 rotatable bonds, 7 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxycyclohexane-1-carboxylic acid;4-[(7-amino-6-bromo-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)oxymethyl]cyclohexane-1-carboxylic acid;6-bromo-3-(4-bromo-2,1-benzoxazol-5-yl)-5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-(1,1-dioxo-1,4-thiazinan-4-yl)-3-(6-methylquinolin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 162089417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).