(5R)-3-[(5-chlorothiadiazol-4-yl)methyl]-5-(2,3-dihydro-1H-inden-5-yl)-5-methylimidazolidine-2,4-dione

C16H15ClN4O2S — CID 9452500

About (5R)-3-[(5-chlorothiadiazol-4-yl)methyl]-5-(2,3-dihydro-1H-inden-5-yl)-5-methylimidazolidine-2,4-dione

(5R)-3-[(5-chlorothiadiazol-4-yl)methyl]-5-(2,3-dihydro-1H-inden-5-yl)-5-methylimidazolidine-2,4-dione (PubChem CID 9452500) has the molecular formula C16H15ClN4O2S and a molecular weight of 362.84 g/mol. Its IUPAC name is (5R)-3-[(5-chlorothiadiazol-4-yl)methyl]-5-(2,3-dihydro-1H-inden-5-yl)-5-methylimidazolidine-2,4-dione.

Molecular Properties

• Compound Name: (5R)-3-[(5-chlorothiadiazol-4-yl)methyl]-5-(2,3-dihydro-1H-inden-5-yl)-5-methylimidazolidine-2,4-dione
• PubChem CID: 9452500
• Molecular Formula: C16H15ClN4O2S
• Molecular Weight: 362.84 g/mol
• Exact Mass: 362.06
• IUPAC Name: (5R)-3-[(5-chlorothiadiazol-4-yl)methyl]-5-(2,3-dihydro-1H-inden-5-yl)-5-methylimidazolidine-2,4-dione
• SMILES: C[C@]1(c2ccc3c(c2)CCC3)NC(=O)N(Cc2nnsc2Cl)C1=O
• InChI: InChI=1S/C16H15ClN4O2S/c1-16(11-6-5-9-3-2-4-10(9)7-11)14(22)21(15(23)18-16)8-12-13(17)24-20-19-12/h5-7H,2-4,8H2,1H3,(H,18,23)/t16-/m1/s1
• InChIKey: DFPYWLCDVWUYIM-MRXNPFEDSA-N
• XLogP: 2.65
• TPSA: 75.19 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	362.84
LogP ≤ 5	2.65
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (5R)-3-[(5-chlorothiadiazol-4-yl)methyl]-5-(2,3-dihydro-1H-inden-5-yl)-5-methylimidazolidine-2,4-dione?

The IUPAC name of (5R)-3-[(5-chlorothiadiazol-4-yl)methyl]-5-(2,3-dihydro-1H-inden-5-yl)-5-methylimidazolidine-2,4-dione (CID 9452500) is (5R)-3-[(5-chlorothiadiazol-4-yl)methyl]-5-(2,3-dihydro-1H-inden-5-yl)-5-methylimidazolidine-2,4-dione.

What is the SMILES notation for (5R)-3-[(5-chlorothiadiazol-4-yl)methyl]-5-(2,3-dihydro-1H-inden-5-yl)-5-methylimidazolidine-2,4-dione?

The canonical SMILES for (5R)-3-[(5-chlorothiadiazol-4-yl)methyl]-5-(2,3-dihydro-1H-inden-5-yl)-5-methylimidazolidine-2,4-dione is C[C@]1(c2ccc3c(c2)CCC3)NC(=O)N(Cc2nnsc2Cl)C1=O.

What is the InChIKey of (5R)-3-[(5-chlorothiadiazol-4-yl)methyl]-5-(2,3-dihydro-1H-inden-5-yl)-5-methylimidazolidine-2,4-dione?

The InChIKey is DFPYWLCDVWUYIM-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H15ClN4O2S/c1-16(11-6-5-9-3-2-4-10(9)7-11)14(22)21(15(23)18-16)8-12-13(17)24-20-19-12/h5-7H,2-4,8H2,1H3,(H,18,23)/t16-/m1/s1.

What are the key properties of (5R)-3-[(5-chlorothiadiazol-4-yl)methyl]-5-(2,3-dihydro-1H-inden-5-yl)-5-methylimidazolidine-2,4-dione?

(5R)-3-[(5-chlorothiadiazol-4-yl)methyl]-5-(2,3-dihydro-1H-inden-5-yl)-5-methylimidazolidine-2,4-dione has a molecular weight of 362.84 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for (5R)-3-[(5-chlorothiadiazol-4-yl)methyl]-5-(2,3-dihydro-1H-inden-5-yl)-5-methylimidazolidine-2,4-dione is sourced from PubChem (CID 9452500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).