carbanide;bis(chromium(3+));methylsulfonyl-[2,3,4-trimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide;methylsulfonyl-[2,3,4-trimethyl-6-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide

C32H50Cr2N4O6S2 — CID 157240868

About carbanide;bis(chromium(3+));methylsulfonyl-[2,3,4-trimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide;methylsulfonyl-[2,3,4-trimethyl-6-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide

carbanide;bis(chromium(3+));methylsulfonyl-[2,3,4-trimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide;methylsulfonyl-[2,3,4-trimethyl-6-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide (PubChem CID 157240868) has the molecular formula C32H50Cr2N4O6S2 and a molecular weight of 754.90 g/mol. Its IUPAC name is carbanide;bis(chromium(3+));methylsulfonyl-[2,3,4-trimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide;methylsulfonyl-[2,3,4-trimethyl-6-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide.

Molecular Properties

• Compound Name: carbanide;bis(chromium(3+));methylsulfonyl-[2,3,4-trimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide;methylsulfonyl-[2,3,4-trimethyl-6-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide
• PubChem CID: 157240868
• Molecular Formula: C32H50Cr2N4O6S2
• Molecular Weight: 754.90 g/mol
• Exact Mass: 754.20
• IUPAC Name: carbanide;bis(chromium(3+));methylsulfonyl-[2,3,4-trimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide;methylsulfonyl-[2,3,4-trimethyl-6-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide
• SMILES: Cc1cc(C2=N[C@@H](C)CO2)c([N-]S(C)(=O)=O)c(C)c1C.Cc1cc(C2=N[C@H](C)CO2)c([N-]S(C)(=O)=O)c(C)c1C.[CH3-].[CH3-].[CH3-].[CH3-].[Cr+3].[Cr+3]
• InChI: InChI=1S/2C14H19N2O3S.4CH3.2Cr/c2*1-8-6-12(14-15-9(2)7-19-14)13(11(4)10(8)3)16-20(5,17)18;;;;;;/h2*6,9H,7H2,1-5H3;4*1H3;;/q6*-1;2*+3/t2*9-;;;;;;/m10....../s1
• InChIKey: OSUKKFGEUWXPLI-CLGIEIDNSA-N
• XLogP: 7.28
• TPSA: 139.66 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 6
• Heavy Atoms: 46
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	754.90
LogP ≤ 5	7.28
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of carbanide;bis(chromium(3+));methylsulfonyl-[2,3,4-trimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide;methylsulfonyl-[2,3,4-trimethyl-6-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide?

The IUPAC name of carbanide;bis(chromium(3+));methylsulfonyl-[2,3,4-trimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide;methylsulfonyl-[2,3,4-trimethyl-6-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide (CID 157240868) is carbanide;bis(chromium(3+));methylsulfonyl-[2,3,4-trimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide;methylsulfonyl-[2,3,4-trimethyl-6-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide.

What is the SMILES notation for carbanide;bis(chromium(3+));methylsulfonyl-[2,3,4-trimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide;methylsulfonyl-[2,3,4-trimethyl-6-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide?

The canonical SMILES for carbanide;bis(chromium(3+));methylsulfonyl-[2,3,4-trimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide;methylsulfonyl-[2,3,4-trimethyl-6-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide is Cc1cc(C2=N[C@@H](C)CO2)c([N-]S(C)(=O)=O)c(C)c1C.Cc1cc(C2=N[C@H](C)CO2)c([N-]S(C)(=O)=O)c(C)c1C.[CH3-].[CH3-].[CH3-].[CH3-].[Cr+3].[Cr+3].

What is the InChIKey of carbanide;bis(chromium(3+));methylsulfonyl-[2,3,4-trimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide;methylsulfonyl-[2,3,4-trimethyl-6-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide?

The InChIKey is OSUKKFGEUWXPLI-CLGIEIDNSA-N. The full InChI is InChI=1S/2C14H19N2O3S.4CH3.2Cr/c2*1-8-6-12(14-15-9(2)7-19-14)13(11(4)10(8)3)16-20(5,17)18;;;;;;/h2*6,9H,7H2,1-5H3;4*1H3;;/q6*-1;2*+3/t2*9-;;;;;;/m10....../s1.

What are the key properties of carbanide;bis(chromium(3+));methylsulfonyl-[2,3,4-trimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide;methylsulfonyl-[2,3,4-trimethyl-6-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide?

carbanide;bis(chromium(3+));methylsulfonyl-[2,3,4-trimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide;methylsulfonyl-[2,3,4-trimethyl-6-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide has a molecular weight of 754.90 g/mol, XLogP of 7.28, 6 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for carbanide;bis(chromium(3+));methylsulfonyl-[2,3,4-trimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide;methylsulfonyl-[2,3,4-trimethyl-6-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide is sourced from PubChem (CID 157240868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).