2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;sulfane

C132H150Cl4F6N28O8S2 — CID 167698354

About 2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;sulfane

2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;sulfane (PubChem CID 167698354) has the molecular formula C132H150Cl4F6N28O8S2 and a molecular weight of 2600.92 g/mol. Its IUPAC name is 2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;sulfane.

Molecular Properties

• Compound Name: 2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;sulfane
• PubChem CID: 167698354
• Molecular Formula: C132H150Cl4F6N28O8S2
• Molecular Weight: 2600.92 g/mol
• Exact Mass: 2597.18
• IUPAC Name: 2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;sulfane
• SMILES: S.S.[2H]C([2H])([2H])N(CC1(COc2nc3c(c(N4CCN(C(=O)C(=C)F)C(CC#N)C4)n2)CCN(c2cccc4ccc(F)c(Cl)c24)C3)CC1)C([2H])([2H])[2H].[2H]C([2H])([2H])N(CC1(COc2nc3c(c(N4CCN(C(=O)C(=C)F)C(CC#N)C4)n2)CCN(c2cccc4cccc(Cl)c24)C3)CC1)C([2H])([2H])[2H].[2H]C([2H])([2H])N(CC1(COc2nc3c(c(N4CCN(C(=O)C(=C)F)[C@@H](C[N+]#[C-])C4)n2)CCN(c2cccc4ccc(F)c(Cl)c24)C3)CC1)C([2H])([2H])[2H].[2H]C([2H])([2H])N(CC1(COc2nc3c(c(N4CCN(C(=O)C(=C)F)[C@@H](C[N+]#[C-])C4)n2)CCN(c2cccc4cccc(Cl)c24)C3)CC1)C([2H])([2H])[2H]
• InChI: InChI=1S/2C33H36ClF2N7O2.2C33H37ClFN7O2.2H2S/c1-21(35)31(44)43-15-14-42(17-23(43)16-37-2)30-24-10-13-41(27-7-5-6-22-8-9-25(36)29(34)28(22)27)18-26(24)38-32(39-30)45-20-33(11-12-33)19-40(3)4;1-21(35)31(44)43-16-15-42(17-23(43)9-13-37)30-24-10-14-41(27-6-4-5-22-7-8-25(36)29(34)28(22)27)18-26(24)38-32(39-30)45-20-33(11-12-33)19-40(2)3;1-22(35)31(43)42-16-15-41(18-24(42)17-36-2)30-25-11-14-40(28-10-6-8-23-7-5-9-26(34)29(23)28)19-27(25)37-32(38-30)44-21-33(12-13-33)20-39(3)4;1-22(35)31(43)42-17-16-41(18-24(42)10-14-36)30-25-11-15-40(28-9-5-7-23-6-4-8-26(34)29(23)28)19-27(25)37-32(38-30)44-21-33(12-13-33)20-39(2)3;;/h5-9,23H,1,10-20H2,3-4H3;4-8,23H,1,9-12,14-20H2,2-3H3;5-10,24H,1,11-21H2,3-4H3;4-9,24H,1,10-13,15-21H2,2-3H3;2*1H2/t23-;;24-;;;/m0.0.../s1/i3D3,4D3;2D3,3D3;3D3,4D3;2D3,3D3
• InChIKey: XZQQCNJVOVLBTN-CKIYAADBSA-N
• XLogP: 20.44
• TPSA: 316.46 Ų
• H-Bond Acceptors: 30
• Rotatable Bonds: 44
• Heavy Atoms: 180
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2600.92
LogP ≤ 5	20.44
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;sulfane?

The IUPAC name of 2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;sulfane (CID 167698354) is 2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;sulfane.

What is the SMILES notation for 2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;sulfane?

The canonical SMILES for 2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;sulfane is S.S.[2H]C([2H])([2H])N(CC1(COc2nc3c(c(N4CCN(C(=O)C(=C)F)C(CC#N)C4)n2)CCN(c2cccc4ccc(F)c(Cl)c24)C3)CC1)C([2H])([2H])[2H].[2H]C([2H])([2H])N(CC1(COc2nc3c(c(N4CCN(C(=O)C(=C)F)C(CC#N)C4)n2)CCN(c2cccc4cccc(Cl)c24)C3)CC1)C([2H])([2H])[2H].[2H]C([2H])([2H])N(CC1(COc2nc3c(c(N4CCN(C(=O)C(=C)F)[C@@H](C[N+]#[C-])C4)n2)CCN(c2cccc4ccc(F)c(Cl)c24)C3)CC1)C([2H])([2H])[2H].[2H]C([2H])([2H])N(CC1(COc2nc3c(c(N4CCN(C(=O)C(=C)F)[C@@H](C[N+]#[C-])C4)n2)CCN(c2cccc4cccc(Cl)c24)C3)CC1)C([2H])([2H])[2H].

What is the InChIKey of 2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;sulfane?

The InChIKey is XZQQCNJVOVLBTN-CKIYAADBSA-N. The full InChI is InChI=1S/2C33H36ClF2N7O2.2C33H37ClFN7O2.2H2S/c1-21(35)31(44)43-15-14-42(17-23(43)16-37-2)30-24-10-13-41(27-7-5-6-22-8-9-25(36)29(34)28(22)27)18-26(24)38-32(39-30)45-20-33(11-12-33)19-40(3)4;1-21(35)31(44)43-16-15-42(17-23(43)9-13-37)30-24-10-14-41(27-6-4-5-22-7-8-25(36)29(34)28(22)27)18-26(24)38-32(39-30)45-20-33(11-12-33)19-40(2)3;1-22(35)31(43)42-16-15-41(18-24(42)17-36-2)30-25-11-14-40(28-10-6-8-23-7-5-9-26(34)29(23)28)19-27(25)37-32(38-30)44-21-33(12-13-33)20-39(3)4;1-22(35)31(43)42-17-16-41(18-24(42)10-14-36)30-25-11-15-40(28-9-5-7-23-6-4-8-26(34)29(23)28)19-27(25)37-32(38-30)44-21-33(12-13-33)20-39(2)3;;/h5-9,23H,1,10-20H2,3-4H3;4-8,23H,1,9-12,14-20H2,2-3H3;5-10,24H,1,11-21H2,3-4H3;4-9,24H,1,10-13,15-21H2,2-3H3;2*1H2/t23-;;24-;;;/m0.0.../s1/i3D3,4D3;2D3,3D3;3D3,4D3;2D3,3D3;;.

What are the key properties of 2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;sulfane?

2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;sulfane has a molecular weight of 2600.92 g/mol, XLogP of 20.44, 44 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloro-7-fluoronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-[4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile;1-[(2R)-4-[2-[[1-[[bis(trideuteriomethyl)amino]methyl]cyclopropyl]methoxy]-7-(8-chloronaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;sulfane is sourced from PubChem (CID 167698354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).