methoxycarbonylazanide;[5-[9-[2-(oxomethylphosphanyl)-1H-imidazol-5-yl]-5H-naphtho[2,3-c]isochromen-3-yl]-1H-imidazol-2-yl]phosphanylmethanone;bis(vanadium(2+))

C29H24N6O7P2V2 — CID 59611132

About methoxycarbonylazanide;[5-[9-[2-(oxomethylphosphanyl)-1H-imidazol-5-yl]-5H-naphtho[2,3-c]isochromen-3-yl]-1H-imidazol-2-yl]phosphanylmethanone;bis(vanadium(2+))

methoxycarbonylazanide;[5-[9-[2-(oxomethylphosphanyl)-1H-imidazol-5-yl]-5H-naphtho[2,3-c]isochromen-3-yl]-1H-imidazol-2-yl]phosphanylmethanone;bis(vanadium(2+)) (PubChem CID 59611132) has the molecular formula C29H24N6O7P2V2 and a molecular weight of 732.38 g/mol. Its IUPAC name is methoxycarbonylazanide;[5-[9-[2-(oxomethylphosphanyl)-1H-imidazol-5-yl]-5H-naphtho[2,3-c]isochromen-3-yl]-1H-imidazol-2-yl]phosphanylmethanone;bis(vanadium(2+)).

Molecular Properties

• Compound Name: methoxycarbonylazanide;[5-[9-[2-(oxomethylphosphanyl)-1H-imidazol-5-yl]-5H-naphtho[2,3-c]isochromen-3-yl]-1H-imidazol-2-yl]phosphanylmethanone;bis(vanadium(2+))
• PubChem CID: 59611132
• Molecular Formula: C29H24N6O7P2V2
• Molecular Weight: 732.38 g/mol
• Exact Mass: 732.01
• IUPAC Name: methoxycarbonylazanide;[5-[9-[2-(oxomethylphosphanyl)-1H-imidazol-5-yl]-5H-naphtho[2,3-c]isochromen-3-yl]-1H-imidazol-2-yl]phosphanylmethanone;bis(vanadium(2+))
• SMILES: COC([NH-])=O.COC([NH-])=O.O=[C-]Pc1ncc(-c2ccc3c(c2)COc2cc4cc(-c5cnc(P[C-]=O)[nH]5)ccc4cc2-3)[nH]1.[V+2].[V+2]
• InChI: InChI=1S/C25H16N4O3P2.2C2H5NO2.2V/c30-12-33-24-26-9-21(28-24)15-2-1-14-7-20-19-4-3-16(22-10-27-25(29-22)34-13-31)6-18(19)11-32-23(20)8-17(14)5-15;2*1-5-2(3)4;;/h1-10,33-34H,11H2,(H,26,28)(H,27,29);2*1H3,(H2,3,4);;/q-2;;;2*+2/p-2
• InChIKey: IHJGAROLWPYCID-UHFFFAOYSA-L
• XLogP: 5.53
• TPSA: 200.93 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 9
• Rotatable Bonds: 6
• Heavy Atoms: 46
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	732.38
LogP ≤ 5	5.53
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of methoxycarbonylazanide;[5-[9-[2-(oxomethylphosphanyl)-1H-imidazol-5-yl]-5H-naphtho[2,3-c]isochromen-3-yl]-1H-imidazol-2-yl]phosphanylmethanone;bis(vanadium(2+))?

The IUPAC name of methoxycarbonylazanide;[5-[9-[2-(oxomethylphosphanyl)-1H-imidazol-5-yl]-5H-naphtho[2,3-c]isochromen-3-yl]-1H-imidazol-2-yl]phosphanylmethanone;bis(vanadium(2+)) (CID 59611132) is methoxycarbonylazanide;[5-[9-[2-(oxomethylphosphanyl)-1H-imidazol-5-yl]-5H-naphtho[2,3-c]isochromen-3-yl]-1H-imidazol-2-yl]phosphanylmethanone;bis(vanadium(2+)).

What is the SMILES notation for methoxycarbonylazanide;[5-[9-[2-(oxomethylphosphanyl)-1H-imidazol-5-yl]-5H-naphtho[2,3-c]isochromen-3-yl]-1H-imidazol-2-yl]phosphanylmethanone;bis(vanadium(2+))?

The canonical SMILES for methoxycarbonylazanide;[5-[9-[2-(oxomethylphosphanyl)-1H-imidazol-5-yl]-5H-naphtho[2,3-c]isochromen-3-yl]-1H-imidazol-2-yl]phosphanylmethanone;bis(vanadium(2+)) is COC([NH-])=O.COC([NH-])=O.O=[C-]Pc1ncc(-c2ccc3c(c2)COc2cc4cc(-c5cnc(P[C-]=O)[nH]5)ccc4cc2-3)[nH]1.[V+2].[V+2].

What is the InChIKey of methoxycarbonylazanide;[5-[9-[2-(oxomethylphosphanyl)-1H-imidazol-5-yl]-5H-naphtho[2,3-c]isochromen-3-yl]-1H-imidazol-2-yl]phosphanylmethanone;bis(vanadium(2+))?

The InChIKey is IHJGAROLWPYCID-UHFFFAOYSA-L. The full InChI is InChI=1S/C25H16N4O3P2.2C2H5NO2.2V/c30-12-33-24-26-9-21(28-24)15-2-1-14-7-20-19-4-3-16(22-10-27-25(29-22)34-13-31)6-18(19)11-32-23(20)8-17(14)5-15;2*1-5-2(3)4;;/h1-10,33-34H,11H2,(H,26,28)(H,27,29);2*1H3,(H2,3,4);;/q-2;;;2*+2/p-2.

What are the key properties of methoxycarbonylazanide;[5-[9-[2-(oxomethylphosphanyl)-1H-imidazol-5-yl]-5H-naphtho[2,3-c]isochromen-3-yl]-1H-imidazol-2-yl]phosphanylmethanone;bis(vanadium(2+))?

methoxycarbonylazanide;[5-[9-[2-(oxomethylphosphanyl)-1H-imidazol-5-yl]-5H-naphtho[2,3-c]isochromen-3-yl]-1H-imidazol-2-yl]phosphanylmethanone;bis(vanadium(2+)) has a molecular weight of 732.38 g/mol, XLogP of 5.53, 6 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for methoxycarbonylazanide;[5-[9-[2-(oxomethylphosphanyl)-1H-imidazol-5-yl]-5H-naphtho[2,3-c]isochromen-3-yl]-1H-imidazol-2-yl]phosphanylmethanone;bis(vanadium(2+)) is sourced from PubChem (CID 59611132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).