4-[6-chloro-3-(4-chloroanilino)imidazo[1,2-a]pyridin-2-yl]phenol

C19H13Cl2N3O — CID 7338008

IUPAC4-[6-chloro-3-(4-chloroanilino)imidazo[1,2-a]pyridin-2-yl]phenol
SMILESOc1ccc(-c2nc3ccc(Cl)cn3c2Nc2ccc(Cl)cc2)cc1
InChIInChI=1S/C19H13Cl2N3O/c20-13-3-6-15(7-4-13)22-19-18(12-1-8-16(25)9-2-12)23-17-10-5-14(21)11-24(17)19/h1-11,22,25H
InChIKeyMPNLGWHSBCBXMC-UHFFFAOYSA-N
MW370.24 g/mol
LogP5.76
Rot. Bonds3

About 4-[6-chloro-3-(4-chloroanilino)imidazo[1,2-a]pyridin-2-yl]phenol

4-[6-chloro-3-(4-chloroanilino)imidazo[1,2-a]pyridin-2-yl]phenol (PubChem CID 7338008) has the molecular formula C19H13Cl2N3O and a molecular weight of 370.24 g/mol. Its IUPAC name is 4-[6-chloro-3-(4-chloroanilino)imidazo[1,2-a]pyridin-2-yl]phenol.

Molecular Properties

Compound Name4-[6-chloro-3-(4-chloroanilino)imidazo[1,2-a]pyridin-2-yl]phenol
PubChem CID7338008
Molecular FormulaC19H13Cl2N3O
Molecular Weight370.24 g/mol
Exact Mass369.04
IUPAC Name4-[6-chloro-3-(4-chloroanilino)imidazo[1,2-a]pyridin-2-yl]phenol
SMILESOc1ccc(-c2nc3ccc(Cl)cn3c2Nc2ccc(Cl)cc2)cc1
InChIInChI=1S/C19H13Cl2N3O/c20-13-3-6-15(7-4-13)22-19-18(12-1-8-16(25)9-2-12)23-17-10-5-14(21)11-24(17)19/h1-11,22,25H
InChIKeyMPNLGWHSBCBXMC-UHFFFAOYSA-N
XLogP5.76
TPSA49.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.24
LogP ≤ 55.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[6-chloro-3-(4-chloroanilino)imidazo[1,2-a]pyridin-2-yl]phenol?
The IUPAC name of 4-[6-chloro-3-(4-chloroanilino)imidazo[1,2-a]pyridin-2-yl]phenol (CID 7338008) is 4-[6-chloro-3-(4-chloroanilino)imidazo[1,2-a]pyridin-2-yl]phenol.
What is the SMILES notation for 4-[6-chloro-3-(4-chloroanilino)imidazo[1,2-a]pyridin-2-yl]phenol?
The canonical SMILES for 4-[6-chloro-3-(4-chloroanilino)imidazo[1,2-a]pyridin-2-yl]phenol is Oc1ccc(-c2nc3ccc(Cl)cn3c2Nc2ccc(Cl)cc2)cc1.
What is the InChIKey of 4-[6-chloro-3-(4-chloroanilino)imidazo[1,2-a]pyridin-2-yl]phenol?
The InChIKey is MPNLGWHSBCBXMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13Cl2N3O/c20-13-3-6-15(7-4-13)22-19-18(12-1-8-16(25)9-2-12)23-17-10-5-14(21)11-24(17)19/h1-11,22,25H.
What are the key properties of 4-[6-chloro-3-(4-chloroanilino)imidazo[1,2-a]pyridin-2-yl]phenol?
4-[6-chloro-3-(4-chloroanilino)imidazo[1,2-a]pyridin-2-yl]phenol has a molecular weight of 370.24 g/mol, XLogP of 5.76, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-chloro-3-(4-chloroanilino)imidazo[1,2-a]pyridin-2-yl]phenol is sourced from PubChem (CID 7338008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).