(4R)-4-(6-chloro-2H-chromen-3-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one

C18H14ClNO3 — CID 95147024

IUPAC(4R)-4-(6-chloro-2H-chromen-3-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1C[C@@H](C2=Cc3cc(Cl)ccc3OC2)c2ccc(O)cc2N1
InChIInChI=1S/C18H14ClNO3/c19-12-1-4-17-10(6-12)5-11(9-23-17)15-8-18(22)20-16-7-13(21)2-3-14(15)16/h1-7,15,21H,8-9H2,(H,20,22)/t15-/m0/s1
InChIKeyURTBGXFBTJUETE-HNNXBMFYSA-N
MW327.77 g/mol
LogP3.95
Rot. Bonds1

About (4R)-4-(6-chloro-2H-chromen-3-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one

(4R)-4-(6-chloro-2H-chromen-3-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one (PubChem CID 95147024) has the molecular formula C18H14ClNO3 and a molecular weight of 327.77 g/mol. Its IUPAC name is (4R)-4-(6-chloro-2H-chromen-3-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name(4R)-4-(6-chloro-2H-chromen-3-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one
PubChem CID95147024
Molecular FormulaC18H14ClNO3
Molecular Weight327.77 g/mol
Exact Mass327.07
IUPAC Name(4R)-4-(6-chloro-2H-chromen-3-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1C[C@@H](C2=Cc3cc(Cl)ccc3OC2)c2ccc(O)cc2N1
InChIInChI=1S/C18H14ClNO3/c19-12-1-4-17-10(6-12)5-11(9-23-17)15-8-18(22)20-16-7-13(21)2-3-14(15)16/h1-7,15,21H,8-9H2,(H,20,22)/t15-/m0/s1
InChIKeyURTBGXFBTJUETE-HNNXBMFYSA-N
XLogP3.95
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.77
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (4R)-4-(6-chloro-2H-chromen-3-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one with MolForge

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Related Compounds

(4S)-7-hydroxy-4-(4-methoxyphenyl)-3,4-dihydro-1H-quinolin-2-one
CID 95166951
(4S)-4-[5-(4-chlorophenoxy)-1,3-dimethylpyrazol-4-yl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one
CID 95130650
9-(3-chlorophenyl)-3,6,8,9-tetrahydro-2H-[1,4]dioxino[2,3-g]quinolin-7-one
CID 3158473
4-amino-7-chloro-3,4-dihydro-1H-quinolin-2-one
CID 82158219
6-chloro-2H-chromene-3-carbonyl chloride
CID 2735716
7-chloro-4-iodo-3,4-dihydro-1H-quinolin-2-one
CID 175622515
4-[2-[(2-fluorophenyl)methoxy]phenyl]-7-hydroxy-3,4-dihydro-1H-quinolin-2-one
CID 91973087
2-(7-hydroxy-2-oxo-3,4-dihydro-1H-quinolin-4-yl)-1H-quinolin-4-one
CID 170512672
(2S)-2-(6-chloro-2H-chromen-3-yl)-3-(2-methoxyethyl)-1,2-dihydroquinazolin-4-one
CID 32610279
9-(5-chloro-2-methoxyphenyl)-3,6,8,9-tetrahydro-2H-[1,4]dioxino[2,3-g]quinolin-7-one
CID 2978934
(9R)-9-(5-chloro-2-methoxyphenyl)-3,6,8,9-tetrahydro-2H-[1,4]dioxino[2,3-g]quinolin-7-one
CID 1256572
7-hydroxy-3,5-dihydro-2H-1,5-benzoxazepin-4-one
CID 82490641

Frequently Asked Questions

What is the IUPAC name of (4R)-4-(6-chloro-2H-chromen-3-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of (4R)-4-(6-chloro-2H-chromen-3-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one (CID 95147024) is (4R)-4-(6-chloro-2H-chromen-3-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for (4R)-4-(6-chloro-2H-chromen-3-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for (4R)-4-(6-chloro-2H-chromen-3-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one is O=C1C[C@@H](C2=Cc3cc(Cl)ccc3OC2)c2ccc(O)cc2N1.
What is the InChIKey of (4R)-4-(6-chloro-2H-chromen-3-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is URTBGXFBTJUETE-HNNXBMFYSA-N. The full InChI is InChI=1S/C18H14ClNO3/c19-12-1-4-17-10(6-12)5-11(9-23-17)15-8-18(22)20-16-7-13(21)2-3-14(15)16/h1-7,15,21H,8-9H2,(H,20,22)/t15-/m0/s1.
What are the key properties of (4R)-4-(6-chloro-2H-chromen-3-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one?
(4R)-4-(6-chloro-2H-chromen-3-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 327.77 g/mol, XLogP of 3.95, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(6-chloro-2H-chromen-3-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 95147024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).