[(5R,6S)-5,6-bis(4-chlorophenyl)-3-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone

C25H25Cl2N3O2S — CID 24968163

IUPAC[(5R,6S)-5,6-bis(4-chlorophenyl)-3-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone
SMILESCC(C)C1=C(C(=O)N2CCOCC2)SC2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N21
InChIInChI=1S/C25H25Cl2N3O2S/c1-15(2)21-23(24(31)29-11-13-32-14-12-29)33-25-28-20(16-3-7-18(26)8-4-16)22(30(21)25)17-5-9-19(27)10-6-17/h3-10,15,20,22H,11-14H2,1-2H3/t20-,22+/m0/s1
InChIKeyDYBQZQOKMHMOEG-RBBKRZOGSA-N
MW502.47 g/mol
LogP5.92
Rot. Bonds4

About [(5R,6S)-5,6-bis(4-chlorophenyl)-3-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone

[(5R,6S)-5,6-bis(4-chlorophenyl)-3-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone (PubChem CID 24968163) has the molecular formula C25H25Cl2N3O2S and a molecular weight of 502.47 g/mol. Its IUPAC name is [(5R,6S)-5,6-bis(4-chlorophenyl)-3-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[(5R,6S)-5,6-bis(4-chlorophenyl)-3-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone
PubChem CID24968163
Molecular FormulaC25H25Cl2N3O2S
Molecular Weight502.47 g/mol
Exact Mass501.10
IUPAC Name[(5R,6S)-5,6-bis(4-chlorophenyl)-3-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone
SMILESCC(C)C1=C(C(=O)N2CCOCC2)SC2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N21
InChIInChI=1S/C25H25Cl2N3O2S/c1-15(2)21-23(24(31)29-11-13-32-14-12-29)33-25-28-20(16-3-7-18(26)8-4-16)22(30(21)25)17-5-9-19(27)10-6-17/h3-10,15,20,22H,11-14H2,1-2H3/t20-,22+/m0/s1
InChIKeyDYBQZQOKMHMOEG-RBBKRZOGSA-N
XLogP5.92
TPSA45.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500502.47
LogP ≤ 55.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [(5R,6S)-5,6-bis(4-chlorophenyl)-3-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone 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 [(5R,6S)-5,6-bis(4-chlorophenyl)-3-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone?
The IUPAC name of [(5R,6S)-5,6-bis(4-chlorophenyl)-3-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone (CID 24968163) is [(5R,6S)-5,6-bis(4-chlorophenyl)-3-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [(5R,6S)-5,6-bis(4-chlorophenyl)-3-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [(5R,6S)-5,6-bis(4-chlorophenyl)-3-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone is CC(C)C1=C(C(=O)N2CCOCC2)SC2=N[C@@H](c3ccc(Cl)cc3)[C@@H](c3ccc(Cl)cc3)N21.
What is the InChIKey of [(5R,6S)-5,6-bis(4-chlorophenyl)-3-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone?
The InChIKey is DYBQZQOKMHMOEG-RBBKRZOGSA-N. The full InChI is InChI=1S/C25H25Cl2N3O2S/c1-15(2)21-23(24(31)29-11-13-32-14-12-29)33-25-28-20(16-3-7-18(26)8-4-16)22(30(21)25)17-5-9-19(27)10-6-17/h3-10,15,20,22H,11-14H2,1-2H3/t20-,22+/m0/s1.
What are the key properties of [(5R,6S)-5,6-bis(4-chlorophenyl)-3-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone?
[(5R,6S)-5,6-bis(4-chlorophenyl)-3-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone has a molecular weight of 502.47 g/mol, XLogP of 5.92, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(5R,6S)-5,6-bis(4-chlorophenyl)-3-propan-2-yl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 24968163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).