methane;methoxymethane;N-[(2S)-3-methoxy-1-[[2-[[(2S)-1-[(2R)-2-methyloxiran-2-yl]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide;molecular hydrogen

C26H44N4O7S — CID 156846565

About methane;methoxymethane;N-[(2S)-3-methoxy-1-[[2-[[(2S)-1-[(2R)-2-methyloxiran-2-yl]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide;molecular hydrogen

methane;methoxymethane;N-[(2S)-3-methoxy-1-[[2-[[(2S)-1-[(2R)-2-methyloxiran-2-yl]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide;molecular hydrogen (PubChem CID 156846565) has the molecular formula C26H44N4O7S and a molecular weight of 556.73 g/mol. Its IUPAC name is methane;methoxymethane;N-[(2S)-3-methoxy-1-[[2-[[(2S)-1-[(2R)-2-methyloxiran-2-yl]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide;molecular hydrogen.

Molecular Properties

• Compound Name: methane;methoxymethane;N-[(2S)-3-methoxy-1-[[2-[[(2S)-1-[(2R)-2-methyloxiran-2-yl]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide;molecular hydrogen
• PubChem CID: 156846565
• Molecular Formula: C26H44N4O7S
• Molecular Weight: 556.73 g/mol
• Exact Mass: 556.29
• IUPAC Name: methane;methoxymethane;N-[(2S)-3-methoxy-1-[[2-[[(2S)-1-[(2R)-2-methyloxiran-2-yl]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide;molecular hydrogen
• SMILES: C.COC.COC[C@H](NC(=O)c1cnc(C)s1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)[C@@]1(C)CO1.[H][H].[H][H].[H][H]
• InChI: InChI=1S/C23H28N4O6S.C2H6O.CH4.3H2/c1-14-24-10-18(34-14)22(31)27-17(12-32-3)21(30)25-11-19(28)26-16(20(29)23(2)13-33-23)9-15-7-5-4-6-8-15;1-3-2;;;;/h4-8,10,16-17H,9,11-13H2,1-3H3,(H,25,30)(H,26,28)(H,27,31);1-2H3;1H4;3*1H/t16-,17-,23+;;;;;/m0...../s1
• InChIKey: DIGBNJKVGUFOEL-RTTAYSANSA-N
• XLogP: 2.03
• TPSA: 148.25 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 9
• Rotatable Bonds: 12
• Heavy Atoms: 38
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	556.73
LogP ≤ 5	2.03
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of methane;methoxymethane;N-[(2S)-3-methoxy-1-[[2-[[(2S)-1-[(2R)-2-methyloxiran-2-yl]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide;molecular hydrogen?

The IUPAC name of methane;methoxymethane;N-[(2S)-3-methoxy-1-[[2-[[(2S)-1-[(2R)-2-methyloxiran-2-yl]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide;molecular hydrogen (CID 156846565) is methane;methoxymethane;N-[(2S)-3-methoxy-1-[[2-[[(2S)-1-[(2R)-2-methyloxiran-2-yl]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide;molecular hydrogen.

What is the SMILES notation for methane;methoxymethane;N-[(2S)-3-methoxy-1-[[2-[[(2S)-1-[(2R)-2-methyloxiran-2-yl]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide;molecular hydrogen?

The canonical SMILES for methane;methoxymethane;N-[(2S)-3-methoxy-1-[[2-[[(2S)-1-[(2R)-2-methyloxiran-2-yl]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide;molecular hydrogen is C.COC.COC[C@H](NC(=O)c1cnc(C)s1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)[C@@]1(C)CO1.[H][H].[H][H].[H][H].

What is the InChIKey of methane;methoxymethane;N-[(2S)-3-methoxy-1-[[2-[[(2S)-1-[(2R)-2-methyloxiran-2-yl]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide;molecular hydrogen?

The InChIKey is DIGBNJKVGUFOEL-RTTAYSANSA-N. The full InChI is InChI=1S/C23H28N4O6S.C2H6O.CH4.3H2/c1-14-24-10-18(34-14)22(31)27-17(12-32-3)21(30)25-11-19(28)26-16(20(29)23(2)13-33-23)9-15-7-5-4-6-8-15;1-3-2;;;;/h4-8,10,16-17H,9,11-13H2,1-3H3,(H,25,30)(H,26,28)(H,27,31);1-2H3;1H4;3*1H/t16-,17-,23+;;;;;/m0...../s1.

What are the key properties of methane;methoxymethane;N-[(2S)-3-methoxy-1-[[2-[[(2S)-1-[(2R)-2-methyloxiran-2-yl]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide;molecular hydrogen?

methane;methoxymethane;N-[(2S)-3-methoxy-1-[[2-[[(2S)-1-[(2R)-2-methyloxiran-2-yl]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide;molecular hydrogen has a molecular weight of 556.73 g/mol, XLogP of 2.03, 12 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for methane;methoxymethane;N-[(2S)-3-methoxy-1-[[2-[[(2S)-1-[(2R)-2-methyloxiran-2-yl]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide;molecular hydrogen is sourced from PubChem (CID 156846565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).