(2R)-3-(3-methoxyphenyl)-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione

C23H19N3O3 — CID 52507364

IUPAC(2R)-3-(3-methoxyphenyl)-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione
SMILESCOc1cccc(N2C(=O)c3ccccc3N[C@@]23C(=O)N(C)c2ccccc23)c1
InChIInChI=1S/C23H19N3O3/c1-25-20-13-6-4-11-18(20)23(22(25)28)24-19-12-5-3-10-17(19)21(27)26(23)15-8-7-9-16(14-15)29-2/h3-14,24H,1-2H3/t23-/m1/s1
InChIKeyPBWUFYYYELKTPA-HSZRJFAPSA-N
MW385.42 g/mol
LogP3.60
Rot. Bonds2

About (2R)-3-(3-methoxyphenyl)-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione

(2R)-3-(3-methoxyphenyl)-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione (PubChem CID 52507364) has the molecular formula C23H19N3O3 and a molecular weight of 385.42 g/mol. Its IUPAC name is (2R)-3-(3-methoxyphenyl)-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione.

Molecular Properties

Compound Name(2R)-3-(3-methoxyphenyl)-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione
PubChem CID52507364
Molecular FormulaC23H19N3O3
Molecular Weight385.42 g/mol
Exact Mass385.14
IUPAC Name(2R)-3-(3-methoxyphenyl)-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione
SMILESCOc1cccc(N2C(=O)c3ccccc3N[C@@]23C(=O)N(C)c2ccccc23)c1
InChIInChI=1S/C23H19N3O3/c1-25-20-13-6-4-11-18(20)23(22(25)28)24-19-12-5-3-10-17(19)21(27)26(23)15-8-7-9-16(14-15)29-2/h3-14,24H,1-2H3/t23-/m1/s1
InChIKeyPBWUFYYYELKTPA-HSZRJFAPSA-N
XLogP3.60
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-3-[(4-methoxyphenyl)methyl]-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione
CID 95881455
(2S)-1'-pentyl-3-phenylspiro[1H-quinazoline-2,3'-indole]-2',4-dione
CID 41457149
(2R)-3-(4-ethoxyphenyl)-1'-ethylspiro[1H-quinazoline-2,3'-indole]-2',4-dione
CID 42583440
(2R)-5'-methoxy-1'-methylspiro[1H-indole-2,3'-indole]-2',3-dione
CID 132531797
(2R)-3-(furan-2-ylmethyl)-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione
CID 29109792
(2R)-3-[(2R)-2-(dimethylamino)-2-phenylethyl]-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione
CID 51717405
5-fluoro-3'-(4-methoxyphenyl)spiro[1H-indole-3,2'-1H-quinazoline]-2,4'-dione
CID 139218295
3'-(4-methoxyphenyl)-5,7-dimethylspiro[1H-indole-3,2'-1H-quinazoline]-2,4'-dione
CID 47006441
3'-(4-fluorophenyl)-7-methoxyspiro[1H-indole-3,2'-1H-quinazoline]-2,4'-dione
CID 91962578
(2R)-1'-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)spiro[1H-quinazoline-2,3'-indole]-2',4-dione
CID 1045960
3-(4-chlorophenyl)-1'-[(2-fluorophenyl)methyl]spiro[1H-quinazoline-2,3'-indole]-2',4-dione
CID 91962328
2-(3-methoxyphenyl)-3-propyl-1,2-dihydroquinazolin-4-one
CID 51172490

Frequently Asked Questions

What is the IUPAC name of (2R)-3-(3-methoxyphenyl)-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione?
The IUPAC name of (2R)-3-(3-methoxyphenyl)-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione (CID 52507364) is (2R)-3-(3-methoxyphenyl)-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione.
What is the SMILES notation for (2R)-3-(3-methoxyphenyl)-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione?
The canonical SMILES for (2R)-3-(3-methoxyphenyl)-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione is COc1cccc(N2C(=O)c3ccccc3N[C@@]23C(=O)N(C)c2ccccc23)c1.
What is the InChIKey of (2R)-3-(3-methoxyphenyl)-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione?
The InChIKey is PBWUFYYYELKTPA-HSZRJFAPSA-N. The full InChI is InChI=1S/C23H19N3O3/c1-25-20-13-6-4-11-18(20)23(22(25)28)24-19-12-5-3-10-17(19)21(27)26(23)15-8-7-9-16(14-15)29-2/h3-14,24H,1-2H3/t23-/m1/s1.
What are the key properties of (2R)-3-(3-methoxyphenyl)-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione?
(2R)-3-(3-methoxyphenyl)-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione has a molecular weight of 385.42 g/mol, XLogP of 3.60, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-(3-methoxyphenyl)-1'-methylspiro[1H-quinazoline-2,3'-indole]-2',4-dione is sourced from PubChem (CID 52507364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).