2-thiophen-2-yl-4-(2-thiophen-3-ylquinazolin-4-yl)morpholine

C20H17N3OS2 — CID 133363520

IUPAC2-thiophen-2-yl-4-(2-thiophen-3-ylquinazolin-4-yl)morpholine
SMILESc1csc(C2CN(c3nc(-c4ccsc4)nc4ccccc34)CCO2)c1
InChIInChI=1S/C20H17N3OS2/c1-2-5-16-15(4-1)20(22-19(21-16)14-7-11-25-13-14)23-8-9-24-17(12-23)18-6-3-10-26-18/h1-7,10-11,13,17H,8-9,12H2
InChIKeyUJZORKAJMKEHHT-UHFFFAOYSA-N
MW379.51 g/mol
LogP5.00
Rot. Bonds3

About 2-thiophen-2-yl-4-(2-thiophen-3-ylquinazolin-4-yl)morpholine

2-thiophen-2-yl-4-(2-thiophen-3-ylquinazolin-4-yl)morpholine (PubChem CID 133363520) has the molecular formula C20H17N3OS2 and a molecular weight of 379.51 g/mol. Its IUPAC name is 2-thiophen-2-yl-4-(2-thiophen-3-ylquinazolin-4-yl)morpholine.

Molecular Properties

Compound Name2-thiophen-2-yl-4-(2-thiophen-3-ylquinazolin-4-yl)morpholine
PubChem CID133363520
Molecular FormulaC20H17N3OS2
Molecular Weight379.51 g/mol
Exact Mass379.08
IUPAC Name2-thiophen-2-yl-4-(2-thiophen-3-ylquinazolin-4-yl)morpholine
SMILESc1csc(C2CN(c3nc(-c4ccsc4)nc4ccccc34)CCO2)c1
InChIInChI=1S/C20H17N3OS2/c1-2-5-16-15(4-1)20(22-19(21-16)14-7-11-25-13-14)23-8-9-24-17(12-23)18-6-3-10-26-18/h1-7,10-11,13,17H,8-9,12H2
InChIKeyUJZORKAJMKEHHT-UHFFFAOYSA-N
XLogP5.00
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.51
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-thiophen-3-yl-4-[4-(thiophen-2-ylmethyl)piperazin-1-yl]quinazoline
CID 55377922
9-(2-thiophen-3-ylquinazolin-4-yl)-2,6-dioxa-9-azaspiro[4.5]decane
CID 133479287
4-(2-thiophen-2-ylquinazolin-4-yl)morpholine-2-carboxamide
CID 49432802
4-[4-(oxolan-3-ylmethyl)piperazin-1-yl]-2-thiophen-3-ylquinazoline
CID 133335933
4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine
CID 133363726
2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine
CID 133289876
N-cyclopropyl-1-(2-thiophen-3-ylquinazolin-4-yl)piperidine-3-carboxamide
CID 49431387
2-[1-[4-(2-thiophen-3-ylquinazolin-4-yl)piperazin-1-yl]ethyl]-1,3-thiazole
CID 133476729
4-[4-(2-methylpyrimidin-4-yl)piperazin-1-yl]-2-thiophen-3-ylquinazoline
CID 133458583
4-(1-phenylpyrazolo[5,4-d]pyrimidin-4-yl)-2-thiophen-2-ylmorpholine
CID 133363467
azepan-1-yl-[1-(2-thiophen-3-ylquinazolin-4-yl)piperidin-4-yl]methanone
CID 24508180
4-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-2-thiophen-3-ylquinazoline
CID 133280022

Frequently Asked Questions

What is the IUPAC name of 2-thiophen-2-yl-4-(2-thiophen-3-ylquinazolin-4-yl)morpholine?
The IUPAC name of 2-thiophen-2-yl-4-(2-thiophen-3-ylquinazolin-4-yl)morpholine (CID 133363520) is 2-thiophen-2-yl-4-(2-thiophen-3-ylquinazolin-4-yl)morpholine.
What is the SMILES notation for 2-thiophen-2-yl-4-(2-thiophen-3-ylquinazolin-4-yl)morpholine?
The canonical SMILES for 2-thiophen-2-yl-4-(2-thiophen-3-ylquinazolin-4-yl)morpholine is c1csc(C2CN(c3nc(-c4ccsc4)nc4ccccc34)CCO2)c1.
What is the InChIKey of 2-thiophen-2-yl-4-(2-thiophen-3-ylquinazolin-4-yl)morpholine?
The InChIKey is UJZORKAJMKEHHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3OS2/c1-2-5-16-15(4-1)20(22-19(21-16)14-7-11-25-13-14)23-8-9-24-17(12-23)18-6-3-10-26-18/h1-7,10-11,13,17H,8-9,12H2.
What are the key properties of 2-thiophen-2-yl-4-(2-thiophen-3-ylquinazolin-4-yl)morpholine?
2-thiophen-2-yl-4-(2-thiophen-3-ylquinazolin-4-yl)morpholine has a molecular weight of 379.51 g/mol, XLogP of 5.00, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-2-yl-4-(2-thiophen-3-ylquinazolin-4-yl)morpholine is sourced from PubChem (CID 133363520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).