N-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[6-[2-[ethyl(methyl)amino]ethyl-methylamino]-2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide

C115H137F5N32O8 — CID 158105613

IUPACN-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[6-[2-[ethyl(methyl)amino]ethyl-methylamino]-2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide
SMILESC=CC(=O)Nc1c(N(C)CCN(C)C(C)C)cc(OC)c(Nc2cc(-c3ccc4c(cnn4C)c3)ncn2)c1F.C=CC(=O)Nc1c(N(C)CCN(C)C(C)C)cc(OC)c(Nc2cc(-c3ccc4cnn(C)c4c3)ncn2)c1F.C=CC(=O)Nc1c(N(C)CCN(C)CC)cc(OC)c(Nc2cc(-c3ccc4c(cnn4C)c3)ncn2)c1F.C=CC(=O)Nc1cc(Nc2cc(-c3ccc4cnn(C)c4c3)ncn2)c(OC(F)F)cc1N(C)CCN(C)C(C)C
InChIInChI=1S/C29H34F2N8O2.2C29H35FN8O2.C28H33FN8O2/c1-7-28(40)36-22-13-23(26(41-29(30)31)15-25(22)38(5)11-10-37(4)18(2)3)35-27-14-21(32-17-33-27)19-8-9-20-16-34-39(6)24(20)12-19;1-8-26(39)35-28-23(37(5)12-11-36(4)18(2)3)15-24(40-7)29(27(28)30)34-25-14-21(31-17-32-25)19-9-10-22-20(13-19)16-33-38(22)6;1-8-26(39)35-28-23(37(5)12-11-36(4)18(2)3)15-24(40-7)29(27(28)30)34-25-14-21(31-17-32-25)19-9-10-20-16-33-38(6)22(20)13-19;1-7-25(38)34-27-22(36(4)12-11-35(3)8-2)15-23(39-6)28(26(27)29)33-24-14-20(30-17-31-24)18-9-10-21-19(13-18)16-32-37(21)5/h7-9,12-18,29H,1,10-11H2,2-6H3,(H,36,40)(H,32,33,35);2*8-10,13-18H,1,11-12H2,2-7H3,(H,35,39)(H,31,32,34);7,9-10,13-17H,1,8,11-12H2,2-6H3,(H,34,38)(H,30,31,33)
InChIKeyFPUDLQFQDUWELG-UHFFFAOYSA-N
MW2190.57 g/mol
LogP19.36
Rot. Bonds45

About N-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[6-[2-[ethyl(methyl)amino]ethyl-methylamino]-2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide

N-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[6-[2-[ethyl(methyl)amino]ethyl-methylamino]-2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide (PubChem CID 158105613) has the molecular formula C115H137F5N32O8 and a molecular weight of 2190.57 g/mol. Its IUPAC name is N-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[6-[2-[ethyl(methyl)amino]ethyl-methylamino]-2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide.

Molecular Properties

Compound NameN-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[6-[2-[ethyl(methyl)amino]ethyl-methylamino]-2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide
PubChem CID158105613
Molecular FormulaC115H137F5N32O8
Molecular Weight2190.57 g/mol
Exact Mass2189.12
IUPAC NameN-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[6-[2-[ethyl(methyl)amino]ethyl-methylamino]-2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide
SMILESC=CC(=O)Nc1c(N(C)CCN(C)C(C)C)cc(OC)c(Nc2cc(-c3ccc4c(cnn4C)c3)ncn2)c1F.C=CC(=O)Nc1c(N(C)CCN(C)C(C)C)cc(OC)c(Nc2cc(-c3ccc4cnn(C)c4c3)ncn2)c1F.C=CC(=O)Nc1c(N(C)CCN(C)CC)cc(OC)c(Nc2cc(-c3ccc4c(cnn4C)c3)ncn2)c1F.C=CC(=O)Nc1cc(Nc2cc(-c3ccc4cnn(C)c4c3)ncn2)c(OC(F)F)cc1N(C)CCN(C)C(C)C
InChIInChI=1S/C29H34F2N8O2.2C29H35FN8O2.C28H33FN8O2/c1-7-28(40)36-22-13-23(26(41-29(30)31)15-25(22)38(5)11-10-37(4)18(2)3)35-27-14-21(32-17-33-27)19-8-9-20-16-34-39(6)24(20)12-19;1-8-26(39)35-28-23(37(5)12-11-36(4)18(2)3)15-24(40-7)29(27(28)30)34-25-14-21(31-17-32-25)19-9-10-22-20(13-19)16-33-38(22)6;1-8-26(39)35-28-23(37(5)12-11-36(4)18(2)3)15-24(40-7)29(27(28)30)34-25-14-21(31-17-32-25)19-9-10-20-16-33-38(6)22(20)13-19;1-7-25(38)34-27-22(36(4)12-11-35(3)8-2)15-23(39-6)28(26(27)29)33-24-14-20(30-17-31-24)18-9-10-21-19(13-18)16-32-37(21)5/h7-9,12-18,29H,1,10-11H2,2-6H3,(H,36,40)(H,32,33,35);2*8-10,13-18H,1,11-12H2,2-7H3,(H,35,39)(H,31,32,34);7,9-10,13-17H,1,8,11-12H2,2-6H3,(H,34,38)(H,30,31,33)
InChIKeyFPUDLQFQDUWELG-UHFFFAOYSA-N
XLogP19.36
TPSA401.76 Ų
H-Bond Donors8
H-Bond Acceptors36
Rotatable Bonds45
Heavy Atoms160
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002190.57
LogP ≤ 519.36
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1036

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze N-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[6-[2-[ethyl(methyl)amino]ethyl-methylamino]-2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide with MolForge

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Related Compounds

N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide
CID 146498483
N-[4-methoxy-5-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[(3S,5R)-3,4,5-trimethylpiperazin-1-yl]ethyl]amino]phenyl]prop-2-enamide
CID 146498413
N-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-2-piperazin-1-ylphenyl]prop-2-enamide
CID 170120201
N-[4-(difluoromethoxy)-2-[3-(dimethylamino)propyl]-5-[[4-(1-methylindazol-5-yl)pyrimidin-2-yl]amino]phenyl]prop-2-enamide
CID 158800181
N-[4-methoxy-2-(4-methyl-1,4-diazepan-1-yl)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide
CID 146498144
5-methoxy-1-N,2-N-dimethyl-4-N-[6-(1-methylindazol-5-yl)pyrimidin-4-yl]-1-N-[2-(propan-2-ylamino)ethyl]benzene-1,2,4-triamine
CID 146561385
N-[4-methoxy-5-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-2-piperazin-1-ylphenyl]prop-2-enamide
CID 170120189
N-[4-methoxy-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]prop-2-enamide
CID 146498519
N-[4-(difluoromethoxy)-2-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]piperidin-1-yl]-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide
CID 146498172
N-[2-[2-[ethyl(methyl)amino]ethyl-methylamino]-5-[[4-(7-fluoro-2-methyl-3-propan-2-yl-1,2-dihydrobenzimidazol-5-yl)pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide
CID 145449383
N-[2-(4-ethylpiperazin-1-yl)-4-methoxy-5-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;4-(4-ethylpiperazin-1-yl)-6-methoxy-1-N-[6-(1-methylindazol-5-yl)pyrimidin-4-yl]benzene-1,3-diamine
CID 161005798
CID 174101565
CID 174101565

Frequently Asked Questions

What is the IUPAC name of N-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[6-[2-[ethyl(methyl)amino]ethyl-methylamino]-2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide?
The IUPAC name of N-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[6-[2-[ethyl(methyl)amino]ethyl-methylamino]-2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide (CID 158105613) is N-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[6-[2-[ethyl(methyl)amino]ethyl-methylamino]-2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide.
What is the SMILES notation for N-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[6-[2-[ethyl(methyl)amino]ethyl-methylamino]-2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide?
The canonical SMILES for N-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[6-[2-[ethyl(methyl)amino]ethyl-methylamino]-2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide is C=CC(=O)Nc1c(N(C)CCN(C)C(C)C)cc(OC)c(Nc2cc(-c3ccc4c(cnn4C)c3)ncn2)c1F.C=CC(=O)Nc1c(N(C)CCN(C)C(C)C)cc(OC)c(Nc2cc(-c3ccc4cnn(C)c4c3)ncn2)c1F.C=CC(=O)Nc1c(N(C)CCN(C)CC)cc(OC)c(Nc2cc(-c3ccc4c(cnn4C)c3)ncn2)c1F.C=CC(=O)Nc1cc(Nc2cc(-c3ccc4cnn(C)c4c3)ncn2)c(OC(F)F)cc1N(C)CCN(C)C(C)C.
What is the InChIKey of N-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[6-[2-[ethyl(methyl)amino]ethyl-methylamino]-2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide?
The InChIKey is FPUDLQFQDUWELG-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H34F2N8O2.2C29H35FN8O2.C28H33FN8O2/c1-7-28(40)36-22-13-23(26(41-29(30)31)15-25(22)38(5)11-10-37(4)18(2)3)35-27-14-21(32-17-33-27)19-8-9-20-16-34-39(6)24(20)12-19;1-8-26(39)35-28-23(37(5)12-11-36(4)18(2)3)15-24(40-7)29(27(28)30)34-25-14-21(31-17-32-25)19-9-10-22-20(13-19)16-33-38(22)6;1-8-26(39)35-28-23(37(5)12-11-36(4)18(2)3)15-24(40-7)29(27(28)30)34-25-14-21(31-17-32-25)19-9-10-20-16-33-38(6)22(20)13-19;1-7-25(38)34-27-22(36(4)12-11-35(3)8-2)15-23(39-6)28(26(27)29)33-24-14-20(30-17-31-24)18-9-10-21-19(13-18)16-32-37(21)5/h7-9,12-18,29H,1,10-11H2,2-6H3,(H,36,40)(H,32,33,35);2*8-10,13-18H,1,11-12H2,2-7H3,(H,35,39)(H,31,32,34);7,9-10,13-17H,1,8,11-12H2,2-6H3,(H,34,38)(H,30,31,33).
What are the key properties of N-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[6-[2-[ethyl(methyl)amino]ethyl-methylamino]-2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide?
N-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[6-[2-[ethyl(methyl)amino]ethyl-methylamino]-2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide has a molecular weight of 2190.57 g/mol, XLogP of 19.36, 45 rotatable bonds, 8 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(difluoromethoxy)-5-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-2-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[6-[2-[ethyl(methyl)amino]ethyl-methylamino]-2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-5-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide;N-[2-fluoro-4-methoxy-3-[[6-(1-methylindazol-6-yl)pyrimidin-4-yl]amino]-6-[methyl-[2-[methyl(propan-2-yl)amino]ethyl]amino]phenyl]prop-2-enamide is sourced from PubChem (CID 158105613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).