2-phenyl-1,3-thiazolidine-4-carbohydrazide

C10H13N3OS — CID 3064949

IUPAC2-phenyl-1,3-thiazolidine-4-carbohydrazide
SMILESNNC(=O)C1CSC(c2ccccc2)N1
InChIInChI=1S/C10H13N3OS/c11-13-9(14)8-6-15-10(12-8)7-4-2-1-3-5-7/h1-5,8,10,12H,6,11H2,(H,13,14)
InChIKeyIEZDZMRGMSXTJU-UHFFFAOYSA-N
MW223.30 g/mol
LogP0.38
Rot. Bonds2

About 2-phenyl-1,3-thiazolidine-4-carbohydrazide

2-phenyl-1,3-thiazolidine-4-carbohydrazide (PubChem CID 3064949) has the molecular formula C10H13N3OS and a molecular weight of 223.30 g/mol. Its IUPAC name is 2-phenyl-1,3-thiazolidine-4-carbohydrazide.

Molecular Properties

Compound Name2-phenyl-1,3-thiazolidine-4-carbohydrazide
PubChem CID3064949
Molecular FormulaC10H13N3OS
Molecular Weight223.30 g/mol
Exact Mass223.08
IUPAC Name2-phenyl-1,3-thiazolidine-4-carbohydrazide
SMILESNNC(=O)C1CSC(c2ccccc2)N1
InChIInChI=1S/C10H13N3OS/c11-13-9(14)8-6-15-10(12-8)7-4-2-1-3-5-7/h1-5,8,10,12H,6,11H2,(H,13,14)
InChIKeyIEZDZMRGMSXTJU-UHFFFAOYSA-N
XLogP0.38
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.30
LogP ≤ 50.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

methyl 2-phenyl-1,3-thiazolidine-4-carboxylate
CID 14790914
(2R,4S)-2-[4-[(2R,4S)-4-carboxy-1,3-thiazolidin-2-yl]phenyl]-1,3-thiazolidine-4-carboxylic acid
CID 694997
N-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 14881601
(4-methoxyphenyl)-(2-phenyl-1,3-thiazolidin-4-yl)methanone
CID 69035805
2-phenyl-1,3-thiazinane-4-carboxylic acid
CID 60919404
(4R)-2-(3-hydroxyphenyl)-1,3-thiazolidine-4-carboxylic acid
CID 6708491
(4R)-2-(4-acetamidophenyl)-1,3-thiazolidine-4-carboxylic acid
CID 11242572
(4S)-2-(3-chlorophenyl)-1,3-thiazolidine-4-carboxylic acid
CID 107773712
(2R,4S)-2-(3-chlorophenyl)-1,3-thiazolidine-4-carboxylic acid
CID 40649091
(2S,4R)-2-(3-bromophenyl)-1,3-thiazolidine-4-carboxylic acid
CID 728223
(2R,4R)-2-(3-bromophenyl)-1,3-thiazolidine-4-carboxylic acid
CID 728224
2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 19894077

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1,3-thiazolidine-4-carbohydrazide?
The IUPAC name of 2-phenyl-1,3-thiazolidine-4-carbohydrazide (CID 3064949) is 2-phenyl-1,3-thiazolidine-4-carbohydrazide.
What is the SMILES notation for 2-phenyl-1,3-thiazolidine-4-carbohydrazide?
The canonical SMILES for 2-phenyl-1,3-thiazolidine-4-carbohydrazide is NNC(=O)C1CSC(c2ccccc2)N1.
What is the InChIKey of 2-phenyl-1,3-thiazolidine-4-carbohydrazide?
The InChIKey is IEZDZMRGMSXTJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3OS/c11-13-9(14)8-6-15-10(12-8)7-4-2-1-3-5-7/h1-5,8,10,12H,6,11H2,(H,13,14).
What are the key properties of 2-phenyl-1,3-thiazolidine-4-carbohydrazide?
2-phenyl-1,3-thiazolidine-4-carbohydrazide has a molecular weight of 223.30 g/mol, XLogP of 0.38, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1,3-thiazolidine-4-carbohydrazide is sourced from PubChem (CID 3064949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).