6-(4-chlorophenyl)-3-[4-[(3S,4S)-3-hydroxy-4-methylpyrrolidin-1-yl]-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(1-methylidene-1-oxo-1,4-thiazinan-4-yl)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[6-[3-(3-methylazetidin-1-yl)pyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[3-methoxy-4-[(3R)-3-methylpyrrolidin-1-yl]phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[6-[(3R)-3-methylpyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloropyrimidin-2-yl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one

C185H175Cl8N37O21S — CID 158483545

About 6-(4-chlorophenyl)-3-[4-[(3S,4S)-3-hydroxy-4-methylpyrrolidin-1-yl]-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(1-methylidene-1-oxo-1,4-thiazinan-4-yl)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[6-[3-(3-methylazetidin-1-yl)pyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[3-methoxy-4-[(3R)-3-methylpyrrolidin-1-yl]phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[6-[(3R)-3-methylpyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloropyrimidin-2-yl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one

6-(4-chlorophenyl)-3-[4-[(3S,4S)-3-hydroxy-4-methylpyrrolidin-1-yl]-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(1-methylidene-1-oxo-1,4-thiazinan-4-yl)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[6-[3-(3-methylazetidin-1-yl)pyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[3-methoxy-4-[(3R)-3-methylpyrrolidin-1-yl]phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[6-[(3R)-3-methylpyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloropyrimidin-2-yl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one (PubChem CID 158483545) has the molecular formula C185H175Cl8N37O21S and a molecular weight of 3568.36 g/mol. Its IUPAC name is 6-(4-chlorophenyl)-3-[4-[(3S,4S)-3-hydroxy-4-methylpyrrolidin-1-yl]-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(1-methylidene-1-oxo-1,4-thiazinan-4-yl)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[6-[3-(3-methylazetidin-1-yl)pyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[3-methoxy-4-[(3R)-3-methylpyrrolidin-1-yl]phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[6-[(3R)-3-methylpyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloropyrimidin-2-yl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one.

Molecular Properties

• Compound Name: 6-(4-chlorophenyl)-3-[4-[(3S,4S)-3-hydroxy-4-methylpyrrolidin-1-yl]-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(1-methylidene-1-oxo-1,4-thiazinan-4-yl)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[6-[3-(3-methylazetidin-1-yl)pyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[3-methoxy-4-[(3R)-3-methylpyrrolidin-1-yl]phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[6-[(3R)-3-methylpyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloropyrimidin-2-yl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one
• PubChem CID: 158483545
• Molecular Formula: C185H175Cl8N37O21S
• Molecular Weight: 3568.36 g/mol
• Exact Mass: 3562.10
• IUPAC Name: 6-(4-chlorophenyl)-3-[4-[(3S,4S)-3-hydroxy-4-methylpyrrolidin-1-yl]-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(1-methylidene-1-oxo-1,4-thiazinan-4-yl)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[6-[3-(3-methylazetidin-1-yl)pyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[3-methoxy-4-[(3R)-3-methylpyrrolidin-1-yl]phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[6-[(3R)-3-methylpyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloropyrimidin-2-yl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one
• SMILES: C=S1(=O)CCN(c2ccc(-n3cnn4cc(-c5ccc(Cl)cc5)cc4c3=O)cc2OC)CC1.CC1CN(C2CCN(c3ccc(-n4cnn5cc(-c6ccc(Cl)cc6)cc5c4=O)cn3)C2)C1.COc1cc(-n2cnn3cc(-c4ccc(Cl)cc4)cc3c2=O)ccc1N1C[C@@H](O)[C@@H](C)C1.COc1cc(-n2cnn3cc(-c4ccc(Cl)cc4)cc3c2=O)ccc1OCC(C)C.COc1cc(-n2cnn3cc(-c4ccc(Cl)cn4)cc3c2=O)ccc1N1CC[C@@H](C)C1.COc1cc(-n2cnn3cc(-c4ccc(Cl)cn4)cc3c2=O)ccc1OCC(O)C1CC1.COc1cc(-n2cnn3cc(-c4ncc(Cl)cn4)cc3c2=O)ccc1OCC(O)C1CC1.C[C@@H]1CCN(c2ccc(-n3cnn4cc(-c5ccc(Cl)cn5)cc4c3=O)cn2)C1
• InChI: InChI=1S/C25H25ClN6O.C24H23ClN4O3S.C24H23ClN4O3.C23H22ClN5O2.C23H21ClN4O4.C23H22ClN3O3.C22H20ClN5O4.C21H19ClN6O/c1-17-12-30(13-17)22-8-9-29(15-22)24-7-6-21(11-27-24)31-16-28-32-14-19(10-23(32)25(31)33)18-2-4-20(26)5-3-18;1-32-23-14-20(7-8-21(23)27-9-11-33(2,31)12-10-27)28-16-26-29-15-18(13-22(29)24(28)30)17-3-5-19(25)6-4-17;1-15-11-27(13-22(15)30)20-8-7-19(10-23(20)32-2)28-14-26-29-12-17(9-21(29)24(28)31)16-3-5-18(25)6-4-16;1-15-7-8-27(12-15)20-6-4-18(10-22(20)31-2)28-14-26-29-13-16(9-21(29)23(28)30)19-5-3-17(24)11-25-19;1-31-22-9-17(5-7-21(22)32-12-20(29)14-2-3-14)27-13-26-28-11-15(8-19(28)23(27)30)18-6-4-16(24)10-25-18;1-15(2)13-30-21-9-8-19(11-22(21)29-3)26-14-25-27-12-17(10-20(27)23(26)28)16-4-6-18(24)7-5-16;1-31-20-7-16(4-5-19(20)32-11-18(29)13-2-3-13)27-12-26-28-10-14(6-17(28)22(27)30)21-24-8-15(23)9-25-21;1-14-6-7-26(11-14)20-5-3-17(10-24-20)27-13-25-28-12-15(8-19(28)21(27)29)18-4-2-16(22)9-23-18/h2-7,10-11,14,16-17,22H,8-9,12-13,15H2,1H3;3-8,13-16H,2,9-12H2,1H3;3-10,12,14-15,22,30H,11,13H2,1-2H3;3-6,9-11,13-15H,7-8,12H2,1-2H3;4-11,13-14,20,29H,2-3,12H2,1H3;4-12,14-15H,13H2,1-3H3;4-10,12-13,18,29H,2-3,11H2,1H3;2-5,8-10,12-14H,6-7,11H2,1H3/t;;15-,22+;15-;;;;14-/m..01...1/s1
• InChIKey: HHUTUEODCAKGPL-XILNGYOXSA-N
• XLogP: 29.17
• TPSA: 584.90 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 58
• Rotatable Bonds: 39
• Heavy Atoms: 252
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3568.36
LogP ≤ 5	29.17
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	58

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-(4-chlorophenyl)-3-[4-[(3S,4S)-3-hydroxy-4-methylpyrrolidin-1-yl]-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(1-methylidene-1-oxo-1,4-thiazinan-4-yl)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[6-[3-(3-methylazetidin-1-yl)pyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[3-methoxy-4-[(3R)-3-methylpyrrolidin-1-yl]phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[6-[(3R)-3-methylpyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloropyrimidin-2-yl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one?

The IUPAC name of 6-(4-chlorophenyl)-3-[4-[(3S,4S)-3-hydroxy-4-methylpyrrolidin-1-yl]-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(1-methylidene-1-oxo-1,4-thiazinan-4-yl)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[6-[3-(3-methylazetidin-1-yl)pyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[3-methoxy-4-[(3R)-3-methylpyrrolidin-1-yl]phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[6-[(3R)-3-methylpyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloropyrimidin-2-yl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one (CID 158483545) is 6-(4-chlorophenyl)-3-[4-[(3S,4S)-3-hydroxy-4-methylpyrrolidin-1-yl]-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(1-methylidene-1-oxo-1,4-thiazinan-4-yl)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[6-[3-(3-methylazetidin-1-yl)pyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[3-methoxy-4-[(3R)-3-methylpyrrolidin-1-yl]phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[6-[(3R)-3-methylpyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloropyrimidin-2-yl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one.

What is the SMILES notation for 6-(4-chlorophenyl)-3-[4-[(3S,4S)-3-hydroxy-4-methylpyrrolidin-1-yl]-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(1-methylidene-1-oxo-1,4-thiazinan-4-yl)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[6-[3-(3-methylazetidin-1-yl)pyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[3-methoxy-4-[(3R)-3-methylpyrrolidin-1-yl]phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[6-[(3R)-3-methylpyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloropyrimidin-2-yl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one?

The canonical SMILES for 6-(4-chlorophenyl)-3-[4-[(3S,4S)-3-hydroxy-4-methylpyrrolidin-1-yl]-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(1-methylidene-1-oxo-1,4-thiazinan-4-yl)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[6-[3-(3-methylazetidin-1-yl)pyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[3-methoxy-4-[(3R)-3-methylpyrrolidin-1-yl]phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[6-[(3R)-3-methylpyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloropyrimidin-2-yl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one is C=S1(=O)CCN(c2ccc(-n3cnn4cc(-c5ccc(Cl)cc5)cc4c3=O)cc2OC)CC1.CC1CN(C2CCN(c3ccc(-n4cnn5cc(-c6ccc(Cl)cc6)cc5c4=O)cn3)C2)C1.COc1cc(-n2cnn3cc(-c4ccc(Cl)cc4)cc3c2=O)ccc1N1C[C@@H](O)[C@@H](C)C1.COc1cc(-n2cnn3cc(-c4ccc(Cl)cc4)cc3c2=O)ccc1OCC(C)C.COc1cc(-n2cnn3cc(-c4ccc(Cl)cn4)cc3c2=O)ccc1N1CC[C@@H](C)C1.COc1cc(-n2cnn3cc(-c4ccc(Cl)cn4)cc3c2=O)ccc1OCC(O)C1CC1.COc1cc(-n2cnn3cc(-c4ncc(Cl)cn4)cc3c2=O)ccc1OCC(O)C1CC1.C[C@@H]1CCN(c2ccc(-n3cnn4cc(-c5ccc(Cl)cn5)cc4c3=O)cn2)C1.

What is the InChIKey of 6-(4-chlorophenyl)-3-[4-[(3S,4S)-3-hydroxy-4-methylpyrrolidin-1-yl]-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(1-methylidene-1-oxo-1,4-thiazinan-4-yl)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[6-[3-(3-methylazetidin-1-yl)pyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[3-methoxy-4-[(3R)-3-methylpyrrolidin-1-yl]phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[6-[(3R)-3-methylpyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloropyrimidin-2-yl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one?

The InChIKey is HHUTUEODCAKGPL-XILNGYOXSA-N. The full InChI is InChI=1S/C25H25ClN6O.C24H23ClN4O3S.C24H23ClN4O3.C23H22ClN5O2.C23H21ClN4O4.C23H22ClN3O3.C22H20ClN5O4.C21H19ClN6O/c1-17-12-30(13-17)22-8-9-29(15-22)24-7-6-21(11-27-24)31-16-28-32-14-19(10-23(32)25(31)33)18-2-4-20(26)5-3-18;1-32-23-14-20(7-8-21(23)27-9-11-33(2,31)12-10-27)28-16-26-29-15-18(13-22(29)24(28)30)17-3-5-19(25)6-4-17;1-15-11-27(13-22(15)30)20-8-7-19(10-23(20)32-2)28-14-26-29-12-17(9-21(29)24(28)31)16-3-5-18(25)6-4-16;1-15-7-8-27(12-15)20-6-4-18(10-22(20)31-2)28-14-26-29-13-16(9-21(29)23(28)30)19-5-3-17(24)11-25-19;1-31-22-9-17(5-7-21(22)32-12-20(29)14-2-3-14)27-13-26-28-11-15(8-19(28)23(27)30)18-6-4-16(24)10-25-18;1-15(2)13-30-21-9-8-19(11-22(21)29-3)26-14-25-27-12-17(10-20(27)23(26)28)16-4-6-18(24)7-5-16;1-31-20-7-16(4-5-19(20)32-11-18(29)13-2-3-13)27-12-26-28-10-14(6-17(28)22(27)30)21-24-8-15(23)9-25-21;1-14-6-7-26(11-14)20-5-3-17(10-24-20)27-13-25-28-12-15(8-19(28)21(27)29)18-4-2-16(22)9-23-18/h2-7,10-11,14,16-17,22H,8-9,12-13,15H2,1H3;3-8,13-16H,2,9-12H2,1H3;3-10,12,14-15,22,30H,11,13H2,1-2H3;3-6,9-11,13-15H,7-8,12H2,1-2H3;4-11,13-14,20,29H,2-3,12H2,1H3;4-12,14-15H,13H2,1-3H3;4-10,12-13,18,29H,2-3,11H2,1H3;2-5,8-10,12-14H,6-7,11H2,1H3/t;;15-,22+;15-;;;;14-/m..01...1/s1.

What are the key properties of 6-(4-chlorophenyl)-3-[4-[(3S,4S)-3-hydroxy-4-methylpyrrolidin-1-yl]-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(1-methylidene-1-oxo-1,4-thiazinan-4-yl)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[6-[3-(3-methylazetidin-1-yl)pyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[3-methoxy-4-[(3R)-3-methylpyrrolidin-1-yl]phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[6-[(3R)-3-methylpyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloropyrimidin-2-yl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one?

6-(4-chlorophenyl)-3-[4-[(3S,4S)-3-hydroxy-4-methylpyrrolidin-1-yl]-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(1-methylidene-1-oxo-1,4-thiazinan-4-yl)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[6-[3-(3-methylazetidin-1-yl)pyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[3-methoxy-4-[(3R)-3-methylpyrrolidin-1-yl]phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[6-[(3R)-3-methylpyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloropyrimidin-2-yl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one has a molecular weight of 3568.36 g/mol, XLogP of 29.17, 39 rotatable bonds, 3 hydrogen bond donors, and 58 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(4-chlorophenyl)-3-[4-[(3S,4S)-3-hydroxy-4-methylpyrrolidin-1-yl]-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(1-methylidene-1-oxo-1,4-thiazinan-4-yl)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(4-chlorophenyl)-3-[6-[3-(3-methylazetidin-1-yl)pyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[3-methoxy-4-[(3R)-3-methylpyrrolidin-1-yl]phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloro-2-pyridinyl)-3-[6-[(3R)-3-methylpyrrolidin-1-yl]-3-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-one;6-(5-chloropyrimidin-2-yl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one is sourced from PubChem (CID 158483545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).