(4R)-3-(cyclopropylsulfamoyl)-1,3-thiazolidine-4-carboxylic acid

C7H12N2O4S2 — CID 104937084

IUPAC(4R)-3-(cyclopropylsulfamoyl)-1,3-thiazolidine-4-carboxylic acid
SMILESO=C(O)[C@@H]1CSCN1S(=O)(=O)NC1CC1
InChIInChI=1S/C7H12N2O4S2/c10-7(11)6-3-14-4-9(6)15(12,13)8-5-1-2-5/h5-6,8H,1-4H2,(H,10,11)/t6-/m0/s1
InChIKeyWSZJRGFABMDKEF-LURJTMIESA-N
MW252.32 g/mol
LogP-0.56
Rot. Bonds4

About (4R)-3-(cyclopropylsulfamoyl)-1,3-thiazolidine-4-carboxylic acid

(4R)-3-(cyclopropylsulfamoyl)-1,3-thiazolidine-4-carboxylic acid (PubChem CID 104937084) has the molecular formula C7H12N2O4S2 and a molecular weight of 252.32 g/mol. Its IUPAC name is (4R)-3-(cyclopropylsulfamoyl)-1,3-thiazolidine-4-carboxylic acid.

Molecular Properties

Compound Name(4R)-3-(cyclopropylsulfamoyl)-1,3-thiazolidine-4-carboxylic acid
PubChem CID104937084
Molecular FormulaC7H12N2O4S2
Molecular Weight252.32 g/mol
Exact Mass252.02
IUPAC Name(4R)-3-(cyclopropylsulfamoyl)-1,3-thiazolidine-4-carboxylic acid
SMILESO=C(O)[C@@H]1CSCN1S(=O)(=O)NC1CC1
InChIInChI=1S/C7H12N2O4S2/c10-7(11)6-3-14-4-9(6)15(12,13)8-5-1-2-5/h5-6,8H,1-4H2,(H,10,11)/t6-/m0/s1
InChIKeyWSZJRGFABMDKEF-LURJTMIESA-N
XLogP-0.56
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 5-0.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(trifluoromethylsulfonyl)-1,3-thiazolidine-4-carboxylic acid
CID 43172894
(4R)-3-(trifluoromethylsulfonyl)-1,3-thiazolidine-4-carboxylic acid
CID 61141627
(4R)-3-cyclohexylsulfonyl-1,3-thiazolidine-4-carboxylic acid
CID 61142378
1-(cyclopropylsulfamoyl)azepane-2-carboxylic acid
CID 114533609
3-ethylsulfonyl-1,3-thiazolidine-4-carboxylic acid
CID 24703125
(4R)-3-pyrrolidin-1-ylsulfonyl-1,3-thiazolidine-4-carboxylic acid
CID 28784467
3-[methyl(propan-2-yl)sulfamoyl]-1,3-thiazolidine-4-carboxylic acid
CID 61455654
(4R)-3-(azepan-1-ylsulfonyl)-1,3-thiazolidine-4-carboxylic acid
CID 28784491
(4R)-3-(cyclopropylcarbamoyl)-1,3-thiazolidine-4-carboxylic acid
CID 61187556
(4R)-3-(3-methoxy-3-oxopropyl)sulfonyl-1,3-thiazolidine-4-carboxylic acid
CID 54951256
3-(2-fluorophenyl)sulfonyl-1,3-thiazolidine-4-carboxylic acid
CID 24705125
3-[(2-nitrophenyl)methylsulfonyl]-1,3-thiazolidine-4-carboxylic acid
CID 62021637

Frequently Asked Questions

What is the IUPAC name of (4R)-3-(cyclopropylsulfamoyl)-1,3-thiazolidine-4-carboxylic acid?
The IUPAC name of (4R)-3-(cyclopropylsulfamoyl)-1,3-thiazolidine-4-carboxylic acid (CID 104937084) is (4R)-3-(cyclopropylsulfamoyl)-1,3-thiazolidine-4-carboxylic acid.
What is the SMILES notation for (4R)-3-(cyclopropylsulfamoyl)-1,3-thiazolidine-4-carboxylic acid?
The canonical SMILES for (4R)-3-(cyclopropylsulfamoyl)-1,3-thiazolidine-4-carboxylic acid is O=C(O)[C@@H]1CSCN1S(=O)(=O)NC1CC1.
What is the InChIKey of (4R)-3-(cyclopropylsulfamoyl)-1,3-thiazolidine-4-carboxylic acid?
The InChIKey is WSZJRGFABMDKEF-LURJTMIESA-N. The full InChI is InChI=1S/C7H12N2O4S2/c10-7(11)6-3-14-4-9(6)15(12,13)8-5-1-2-5/h5-6,8H,1-4H2,(H,10,11)/t6-/m0/s1.
What are the key properties of (4R)-3-(cyclopropylsulfamoyl)-1,3-thiazolidine-4-carboxylic acid?
(4R)-3-(cyclopropylsulfamoyl)-1,3-thiazolidine-4-carboxylic acid has a molecular weight of 252.32 g/mol, XLogP of -0.56, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-3-(cyclopropylsulfamoyl)-1,3-thiazolidine-4-carboxylic acid is sourced from PubChem (CID 104937084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).