1-[(2R)-4-[(7S)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;1-[(2R)-4-[(7R)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7S)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7R)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one

C130H136Cl2F10N24O12 — CID 167611081

About 1-[(2R)-4-[(7S)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;1-[(2R)-4-[(7R)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7S)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7R)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one

1-[(2R)-4-[(7S)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;1-[(2R)-4-[(7R)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7S)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7R)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one (PubChem CID 167611081) has the molecular formula C130H136Cl2F10N24O12 and a molecular weight of 2487.56 g/mol. Its IUPAC name is 1-[(2R)-4-[(7S)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;1-[(2R)-4-[(7R)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7S)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7R)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one.

Molecular Properties

• Compound Name: 1-[(2R)-4-[(7S)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;1-[(2R)-4-[(7R)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7S)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7R)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one
• PubChem CID: 167611081
• Molecular Formula: C130H136Cl2F10N24O12
• Molecular Weight: 2487.56 g/mol
• Exact Mass: 2485.00
• IUPAC Name: 1-[(2R)-4-[(7S)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;1-[(2R)-4-[(7R)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7S)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7R)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one
• SMILES: [C-]#[N+]C[C@H]1CN(c2nc(OC[C@H]3CCCN3C)nc3c2CO[C@@H](c2cccc4ccc(C(F)(F)F)cc24)C3)CCN1C(=O)C(=C)F.[C-]#[N+]C[C@H]1CN(c2nc(OC[C@H]3CCCN3C)nc3c2CO[C@@H](c2cccc4cccc(Cl)c24)C3)CCN1C(=O)C(=C)F.[C-]#[N+]C[C@H]1CN(c2nc(OC[C@H]3CCCN3C)nc3c2CO[C@H](c2cccc4ccc(C(F)(F)F)cc24)C3)CCN1C(=O)C(=C)F.[C-]#[N+]C[C@H]1CN(c2nc(OC[C@H]3CCCN3C)nc3c2CO[C@H](c2cccc4cccc(Cl)c24)C3)CCN1C(=O)C(=C)F
• InChI: InChI=1S/2C33H34F4N6O3.2C32H34ClFN6O3/c2*1-20(34)31(44)43-13-12-42(17-24(43)16-38-2)30-27-19-45-29(15-28(27)39-32(40-30)46-18-23-7-5-11-41(23)3)25-8-4-6-21-9-10-22(14-26(21)25)33(35,36)37;2*1-20(34)31(41)40-14-13-39(17-23(40)16-35-2)30-25-19-42-28(24-10-4-7-21-8-5-11-26(33)29(21)24)15-27(25)36-32(37-30)43-18-22-9-6-12-38(22)3/h2*4,6,8-10,14,23-24,29H,1,5,7,11-13,15-19H2,3H3;2*4-5,7-8,10-11,22-23,28H,1,6,9,12-19H2,3H3/t23-,24+,29+;23-,24+,29-;22-,23+,28+;22-,23+,28-/m1111/s1
• InChIKey: LBFZEKVKLBCDLM-BNRJGPRXSA-N
• XLogP: 20.69
• TPSA: 301.56 Ų
• H-Bond Acceptors: 28
• Rotatable Bonds: 28
• Heavy Atoms: 178
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2487.56
LogP ≤ 5	20.69
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	28

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 1-[(2R)-4-[(7S)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;1-[(2R)-4-[(7R)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7S)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7R)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one?

The IUPAC name of 1-[(2R)-4-[(7S)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;1-[(2R)-4-[(7R)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7S)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7R)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one (CID 167611081) is 1-[(2R)-4-[(7S)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;1-[(2R)-4-[(7R)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7S)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7R)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one.

What is the SMILES notation for 1-[(2R)-4-[(7S)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;1-[(2R)-4-[(7R)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7S)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7R)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one?

The canonical SMILES for 1-[(2R)-4-[(7S)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;1-[(2R)-4-[(7R)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7S)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7R)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one is [C-]#[N+]C[C@H]1CN(c2nc(OC[C@H]3CCCN3C)nc3c2CO[C@@H](c2cccc4ccc(C(F)(F)F)cc24)C3)CCN1C(=O)C(=C)F.[C-]#[N+]C[C@H]1CN(c2nc(OC[C@H]3CCCN3C)nc3c2CO[C@@H](c2cccc4cccc(Cl)c24)C3)CCN1C(=O)C(=C)F.[C-]#[N+]C[C@H]1CN(c2nc(OC[C@H]3CCCN3C)nc3c2CO[C@H](c2cccc4ccc(C(F)(F)F)cc24)C3)CCN1C(=O)C(=C)F.[C-]#[N+]C[C@H]1CN(c2nc(OC[C@H]3CCCN3C)nc3c2CO[C@H](c2cccc4cccc(Cl)c24)C3)CCN1C(=O)C(=C)F.

What is the InChIKey of 1-[(2R)-4-[(7S)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;1-[(2R)-4-[(7R)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7S)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7R)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one?

The InChIKey is LBFZEKVKLBCDLM-BNRJGPRXSA-N. The full InChI is InChI=1S/2C33H34F4N6O3.2C32H34ClFN6O3/c2*1-20(34)31(44)43-13-12-42(17-24(43)16-38-2)30-27-19-45-29(15-28(27)39-32(40-30)46-18-23-7-5-11-41(23)3)25-8-4-6-21-9-10-22(14-26(21)25)33(35,36)37;2*1-20(34)31(41)40-14-13-39(17-23(40)16-35-2)30-25-19-42-28(24-10-4-7-21-8-5-11-26(33)29(21)24)15-27(25)36-32(37-30)43-18-22-9-6-12-38(22)3/h2*4,6,8-10,14,23-24,29H,1,5,7,11-13,15-19H2,3H3;2*4-5,7-8,10-11,22-23,28H,1,6,9,12-19H2,3H3/t23-,24+,29+;23-,24+,29-;22-,23+,28+;22-,23+,28-/m1111/s1.

What are the key properties of 1-[(2R)-4-[(7S)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;1-[(2R)-4-[(7R)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7S)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7R)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one?

1-[(2R)-4-[(7S)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;1-[(2R)-4-[(7R)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7S)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7R)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one has a molecular weight of 2487.56 g/mol, XLogP of 20.69, 28 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[(2R)-4-[(7S)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;1-[(2R)-4-[(7R)-7-(8-chloronaphthalen-1-yl)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]-2-fluoroprop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7S)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;2-fluoro-1-[(2R)-2-(isocyanomethyl)-4-[(7R)-2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-7-[7-(trifluoromethyl)naphthalen-1-yl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one is sourced from PubChem (CID 167611081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).