(4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanamide

C16H19N3O5S — CID 15342518

IUPAC(4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanamide
SMILESCOC[C@H]1CN(c2ccc3nc([C@@H](O)CCC(N)=O)sc3c2)C(=O)O1
InChIInChI=1S/C16H19N3O5S/c1-23-8-10-7-19(16(22)24-10)9-2-3-11-13(6-9)25-15(18-11)12(20)4-5-14(17)21/h2-3,6,10,12,20H,4-5,7-8H2,1H3,(H2,17,21)/t10-,12+/m1/s1
InChIKeyRNOKJOWQIWMZOC-PWSUYJOCSA-N
MW365.41 g/mol
LogP1.57
Rot. Bonds7

About (4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanamide

(4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanamide (PubChem CID 15342518) has the molecular formula C16H19N3O5S and a molecular weight of 365.41 g/mol. Its IUPAC name is (4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanamide.

Molecular Properties

Compound Name(4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanamide
PubChem CID15342518
Molecular FormulaC16H19N3O5S
Molecular Weight365.41 g/mol
Exact Mass365.10
IUPAC Name(4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanamide
SMILESCOC[C@H]1CN(c2ccc3nc([C@@H](O)CCC(N)=O)sc3c2)C(=O)O1
InChIInChI=1S/C16H19N3O5S/c1-23-8-10-7-19(16(22)24-10)9-2-3-11-13(6-9)25-15(18-11)12(20)4-5-14(17)21/h2-3,6,10,12,20H,4-5,7-8H2,1H3,(H2,17,21)/t10-,12+/m1/s1
InChIKeyRNOKJOWQIWMZOC-PWSUYJOCSA-N
XLogP1.57
TPSA114.98 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.41
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze (4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanamide?
The IUPAC name of (4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanamide (CID 15342518) is (4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanamide.
What is the SMILES notation for (4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanamide?
The canonical SMILES for (4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanamide is COC[C@H]1CN(c2ccc3nc([C@@H](O)CCC(N)=O)sc3c2)C(=O)O1.
What is the InChIKey of (4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanamide?
The InChIKey is RNOKJOWQIWMZOC-PWSUYJOCSA-N. The full InChI is InChI=1S/C16H19N3O5S/c1-23-8-10-7-19(16(22)24-10)9-2-3-11-13(6-9)25-15(18-11)12(20)4-5-14(17)21/h2-3,6,10,12,20H,4-5,7-8H2,1H3,(H2,17,21)/t10-,12+/m1/s1.
What are the key properties of (4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanamide?
(4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanamide has a molecular weight of 365.41 g/mol, XLogP of 1.57, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanamide is sourced from PubChem (CID 15342518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).