(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone

C20H18N2O2S — CID 2354998

IUPAC(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone
SMILESO=C(c1ccccc1)c1sc(N2CCOCC2)nc1-c1ccccc1
InChIInChI=1S/C20H18N2O2S/c23-18(16-9-5-2-6-10-16)19-17(15-7-3-1-4-8-15)21-20(25-19)22-11-13-24-14-12-22/h1-10H,11-14H2
InChIKeyLHLMRDAASBJJEP-UHFFFAOYSA-N
MW350.44 g/mol
LogP3.88
Rot. Bonds4

About (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone

(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone (PubChem CID 2354998) has the molecular formula C20H18N2O2S and a molecular weight of 350.44 g/mol. Its IUPAC name is (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone.

Molecular Properties

Compound Name(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone
PubChem CID2354998
Molecular FormulaC20H18N2O2S
Molecular Weight350.44 g/mol
Exact Mass350.11
IUPAC Name(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone
SMILESO=C(c1ccccc1)c1sc(N2CCOCC2)nc1-c1ccccc1
InChIInChI=1S/C20H18N2O2S/c23-18(16-9-5-2-6-10-16)19-17(15-7-3-1-4-8-15)21-20(25-19)22-11-13-24-14-12-22/h1-10H,11-14H2
InChIKeyLHLMRDAASBJJEP-UHFFFAOYSA-N
XLogP3.88
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.44
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)benzamide
CID 981611
Ethyl 5-benzoyl-4-phenylthiazol-2-ylcarbamate
CID 7315331
4-(4,5-Diphenyl-1,3-thiazol-2-yl)morpholine
CID 9509183
(2-Amino-4-phenyl-1,3-thiazol-5-yl)(phenyl)methanone
CID 774758
N-(5-acetyl-4-phenyl-1,3-thiazol-2-yl)benzamide
CID 4093356
[2-(1-Azepanyl)-4-phenyl-1,3-thiazol-5-yl](phenyl)methanone
CID 4437359
N-(5-(4-Methylbenzoyl)-4-phenylthiazol-2-yl)benzamide
CID 46228971
2-(Morpholin-4-yl)-4-phenyl-1,3-thiazole-5-carbaldehyde
CID 2326533
N-(5-benzoyl-4-phenyl-2-thiazolyl)carbamic acid methyl ester
CID 851892
(2-Morpholino-4-phenylthiazol-5-yl)(piperidin-1-yl)methanone
CID 1236967
N-cyclohexyl-2-(morpholin-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide
CID 1236968
Phenyl-(4-phenyl-2-phenylamino-thiazol-5-yl)-methanone
CID 1241166

Frequently Asked Questions

What is the IUPAC name of (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone?
The IUPAC name of (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone (CID 2354998) is (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone.
What is the SMILES notation for (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone?
The canonical SMILES for (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone is O=C(c1ccccc1)c1sc(N2CCOCC2)nc1-c1ccccc1.
What is the InChIKey of (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone?
The InChIKey is LHLMRDAASBJJEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2S/c23-18(16-9-5-2-6-10-16)19-17(15-7-3-1-4-8-15)21-20(25-19)22-11-13-24-14-12-22/h1-10H,11-14H2.
What are the key properties of (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone?
(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone has a molecular weight of 350.44 g/mol, XLogP of 3.88, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone is sourced from PubChem (CID 2354998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).