1-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-3-fluoropyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3S,4R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3R,4S)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol;(3R)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol

C113H140F6N40O10 — CID 158070801

IUPAC1-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-3-fluoropyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3S,4R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3R,4S)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol;(3R)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol
SMILESCOc1cc2nc(N)n3nc([C@@H]4CCCN(c5cnn([C@@H](C)C(C)(C)O)c5)C4)nc3c2cc1F.COc1cc2nc(N)n3nc([C@@H]4CCCN(c5cnn([C@H](C)C(C)(C)O)c5)C4)nc3c2cc1F.COc1cc2nc(N)n3nc([C@@H]4CN(c5cnn(CC(C)(C)O)c5)CC[C@H]4C)nc3c2cc1F.COc1cc2nc(N)n3nc([C@@]4(F)CCN(c5cnn(CC(C)(C)O)c5)C4)nc3c2cc1F.COc1cc2nc(N)n3nc([C@H]4CN(c5cnn(CC(C)(C)O)c5)CC[C@@H]4C)nc3c2cc1F
InChIInChI=1S/4C23H29FN8O2.C21H24F2N8O2/c2*1-13-5-6-30(14-9-26-31(10-14)12-23(2,3)33)11-16(13)20-28-21-15-7-17(24)19(34-4)8-18(15)27-22(25)32(21)29-20;2*1-13(23(2,3)33)31-12-15(10-26-31)30-7-5-6-14(11-30)20-28-21-16-8-17(24)19(34-4)9-18(16)27-22(25)32(21)29-20;1-20(2,32)10-30-9-12(8-25-30)29-5-4-21(23,11-29)18-27-17-13-6-14(22)16(33-3)7-15(13)26-19(24)31(17)28-18/h2*7-10,13,16,33H,5-6,11-12H2,1-4H3,(H2,25,27);2*8-10,12-14,33H,5-7,11H2,1-4H3,(H2,25,27);6-9,32H,4-5,10-11H2,1-3H3,(H2,24,26)/t2*13-,16-;13-,14+;13-,14-;21-/m10011/s1
InChIKeyFLUKATRTQDOVPJ-NCXREKJNSA-N
MW2332.62 g/mol
LogP13.10
Rot. Bonds25

About 1-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-3-fluoropyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3S,4R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3R,4S)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol;(3R)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol

1-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-3-fluoropyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3S,4R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3R,4S)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol;(3R)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol (PubChem CID 158070801) has the molecular formula C113H140F6N40O10 and a molecular weight of 2332.62 g/mol. Its IUPAC name is 1-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-3-fluoropyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3S,4R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3R,4S)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol;(3R)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol.

Molecular Properties

Compound Name1-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-3-fluoropyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3S,4R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3R,4S)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol;(3R)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol
PubChem CID158070801
Molecular FormulaC113H140F6N40O10
Molecular Weight2332.62 g/mol
Exact Mass2331.16
IUPAC Name1-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-3-fluoropyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3S,4R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3R,4S)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol;(3R)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol
SMILESCOc1cc2nc(N)n3nc([C@@H]4CCCN(c5cnn([C@@H](C)C(C)(C)O)c5)C4)nc3c2cc1F.COc1cc2nc(N)n3nc([C@@H]4CCCN(c5cnn([C@H](C)C(C)(C)O)c5)C4)nc3c2cc1F.COc1cc2nc(N)n3nc([C@@H]4CN(c5cnn(CC(C)(C)O)c5)CC[C@H]4C)nc3c2cc1F.COc1cc2nc(N)n3nc([C@@]4(F)CCN(c5cnn(CC(C)(C)O)c5)C4)nc3c2cc1F.COc1cc2nc(N)n3nc([C@H]4CN(c5cnn(CC(C)(C)O)c5)CC[C@@H]4C)nc3c2cc1F
InChIInChI=1S/4C23H29FN8O2.C21H24F2N8O2/c2*1-13-5-6-30(14-9-26-31(10-14)12-23(2,3)33)11-16(13)20-28-21-15-7-17(24)19(34-4)8-18(15)27-22(25)32(21)29-20;2*1-13(23(2,3)33)31-12-15(10-26-31)30-7-5-6-14(11-30)20-28-21-16-8-17(24)19(34-4)9-18(16)27-22(25)32(21)29-20;1-20(2,32)10-30-9-12(8-25-30)29-5-4-21(23,11-29)18-27-17-13-6-14(22)16(33-3)7-15(13)26-19(24)31(17)28-18/h2*7-10,13,16,33H,5-6,11-12H2,1-4H3,(H2,25,27);2*8-10,12-14,33H,5-7,11H2,1-4H3,(H2,25,27);6-9,32H,4-5,10-11H2,1-3H3,(H2,24,26)/t2*13-,16-;13-,14+;13-,14-;21-/m10011/s1
InChIKeyFLUKATRTQDOVPJ-NCXREKJNSA-N
XLogP13.10
TPSA598.10 Ų
H-Bond Donors10
H-Bond Acceptors50
Rotatable Bonds25
Heavy Atoms169
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002332.62
LogP ≤ 513.10
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1050

Analyze 1-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-3-fluoropyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3S,4R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3R,4S)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol;(3R)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol with MolForge

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Related Compounds

US11312719, Example 21
CID 146650441
US11312719, Example 140
CID 146650486
US11312719, Example 236
CID 146650494
US11312719, Example 109
CID 146650716
US11312719, Example 135
CID 146650720
US11312719, Example 18
CID 146650735
US11312719, Example 19
CID 146650736
US11312719, Example 96
CID 146650749
US11312719, Example 11
CID 146650983
US11312719, Example 126
CID 146651014
US11312719, Example 161
CID 146651024
US11312719, Example 250
CID 146651029

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-3-fluoropyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3S,4R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3R,4S)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol;(3R)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol?
The IUPAC name of 1-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-3-fluoropyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3S,4R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3R,4S)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol;(3R)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol (CID 158070801) is 1-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-3-fluoropyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3S,4R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3R,4S)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol;(3R)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol.
What is the SMILES notation for 1-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-3-fluoropyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3S,4R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3R,4S)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol;(3R)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol?
The canonical SMILES for 1-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-3-fluoropyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3S,4R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3R,4S)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol;(3R)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol is COc1cc2nc(N)n3nc([C@@H]4CCCN(c5cnn([C@@H](C)C(C)(C)O)c5)C4)nc3c2cc1F.COc1cc2nc(N)n3nc([C@@H]4CCCN(c5cnn([C@H](C)C(C)(C)O)c5)C4)nc3c2cc1F.COc1cc2nc(N)n3nc([C@@H]4CN(c5cnn(CC(C)(C)O)c5)CC[C@H]4C)nc3c2cc1F.COc1cc2nc(N)n3nc([C@@]4(F)CCN(c5cnn(CC(C)(C)O)c5)C4)nc3c2cc1F.COc1cc2nc(N)n3nc([C@H]4CN(c5cnn(CC(C)(C)O)c5)CC[C@@H]4C)nc3c2cc1F.
What is the InChIKey of 1-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-3-fluoropyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3S,4R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3R,4S)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol;(3R)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol?
The InChIKey is FLUKATRTQDOVPJ-NCXREKJNSA-N. The full InChI is InChI=1S/4C23H29FN8O2.C21H24F2N8O2/c2*1-13-5-6-30(14-9-26-31(10-14)12-23(2,3)33)11-16(13)20-28-21-15-7-17(24)19(34-4)8-18(15)27-22(25)32(21)29-20;2*1-13(23(2,3)33)31-12-15(10-26-31)30-7-5-6-14(11-30)20-28-21-16-8-17(24)19(34-4)9-18(16)27-22(25)32(21)29-20;1-20(2,32)10-30-9-12(8-25-30)29-5-4-21(23,11-29)18-27-17-13-6-14(22)16(33-3)7-15(13)26-19(24)31(17)28-18/h2*7-10,13,16,33H,5-6,11-12H2,1-4H3,(H2,25,27);2*8-10,12-14,33H,5-7,11H2,1-4H3,(H2,25,27);6-9,32H,4-5,10-11H2,1-3H3,(H2,24,26)/t2*13-,16-;13-,14+;13-,14-;21-/m10011/s1.
What are the key properties of 1-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-3-fluoropyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3S,4R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3R,4S)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol;(3R)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol?
1-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-3-fluoropyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3S,4R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3R,4S)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol;(3R)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol has a molecular weight of 2332.62 g/mol, XLogP of 13.10, 25 rotatable bonds, 10 hydrogen bond donors, and 50 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-3-fluoropyrrolidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3S,4R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[(3R,4S)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)-4-methylpiperidin-1-yl]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol;(3R)-3-[4-[(3R)-3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]pyrazol-1-yl]-2-methylbutan-2-ol is sourced from PubChem (CID 158070801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).