2-(1,3-thiazol-2-yl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione

C18H10N2O3S2 — CID 3829532

IUPAC2-(1,3-thiazol-2-yl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione
SMILESO=C1c2oc3ccccc3c(=O)c2C(c2cccs2)N1c1nccs1
InChIInChI=1S/C18H10N2O3S2/c21-15-10-4-1-2-5-11(10)23-16-13(15)14(12-6-3-8-24-12)20(17(16)22)18-19-7-9-25-18/h1-9,14H
InChIKeyRMNLLMQERNYAJE-UHFFFAOYSA-N
MW366.42 g/mol
LogP4.06
Rot. Bonds2

About 2-(1,3-thiazol-2-yl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione

2-(1,3-thiazol-2-yl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione (PubChem CID 3829532) has the molecular formula C18H10N2O3S2 and a molecular weight of 366.42 g/mol. Its IUPAC name is 2-(1,3-thiazol-2-yl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione.

Molecular Properties

Compound Name2-(1,3-thiazol-2-yl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione
PubChem CID3829532
Molecular FormulaC18H10N2O3S2
Molecular Weight366.42 g/mol
Exact Mass366.01
IUPAC Name2-(1,3-thiazol-2-yl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione
SMILESO=C1c2oc3ccccc3c(=O)c2C(c2cccs2)N1c1nccs1
InChIInChI=1S/C18H10N2O3S2/c21-15-10-4-1-2-5-11(10)23-16-13(15)14(12-6-3-8-24-12)20(17(16)22)18-19-7-9-25-18/h1-9,14H
InChIKeyRMNLLMQERNYAJE-UHFFFAOYSA-N
XLogP4.06
TPSA63.41 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(1,3-thiazol-2-yl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione?
The IUPAC name of 2-(1,3-thiazol-2-yl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione (CID 3829532) is 2-(1,3-thiazol-2-yl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione.
What is the SMILES notation for 2-(1,3-thiazol-2-yl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione?
The canonical SMILES for 2-(1,3-thiazol-2-yl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione is O=C1c2oc3ccccc3c(=O)c2C(c2cccs2)N1c1nccs1.
What is the InChIKey of 2-(1,3-thiazol-2-yl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione?
The InChIKey is RMNLLMQERNYAJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10N2O3S2/c21-15-10-4-1-2-5-11(10)23-16-13(15)14(12-6-3-8-24-12)20(17(16)22)18-19-7-9-25-18/h1-9,14H.
What are the key properties of 2-(1,3-thiazol-2-yl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione?
2-(1,3-thiazol-2-yl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione has a molecular weight of 366.42 g/mol, XLogP of 4.06, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-thiazol-2-yl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione is sourced from PubChem (CID 3829532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).