2,3,9,10-tetramethoxy-7,11b,12,13-tetrahydroquinolino[1,2-c]quinazolin-6-one

C20H22N2O5 — CID 12693390

IUPAC2,3,9,10-tetramethoxy-7,11b,12,13-tetrahydroquinolino[1,2-c]quinazolin-6-one
SMILESCOc1cc2c(cc1OC)N1C(=O)Nc3cc(OC)c(OC)cc3C1CC2
InChIInChI=1S/C20H22N2O5/c1-24-16-7-11-5-6-14-12-8-17(25-2)18(26-3)9-13(12)21-20(23)22(14)15(11)10-19(16)27-4/h7-10,14H,5-6H2,1-4H3,(H,21,23)
InChIKeyGREQXWPQNABTHP-UHFFFAOYSA-N
MW370.41 g/mol
LogP3.76
Rot. Bonds4

About 2,3,9,10-tetramethoxy-7,11b,12,13-tetrahydroquinolino[1,2-c]quinazolin-6-one

2,3,9,10-tetramethoxy-7,11b,12,13-tetrahydroquinolino[1,2-c]quinazolin-6-one (PubChem CID 12693390) has the molecular formula C20H22N2O5 and a molecular weight of 370.41 g/mol. Its IUPAC name is 2,3,9,10-tetramethoxy-7,11b,12,13-tetrahydroquinolino[1,2-c]quinazolin-6-one.

Molecular Properties

Compound Name2,3,9,10-tetramethoxy-7,11b,12,13-tetrahydroquinolino[1,2-c]quinazolin-6-one
PubChem CID12693390
Molecular FormulaC20H22N2O5
Molecular Weight370.41 g/mol
Exact Mass370.15
IUPAC Name2,3,9,10-tetramethoxy-7,11b,12,13-tetrahydroquinolino[1,2-c]quinazolin-6-one
SMILESCOc1cc2c(cc1OC)N1C(=O)Nc3cc(OC)c(OC)cc3C1CC2
InChIInChI=1S/C20H22N2O5/c1-24-16-7-11-5-6-14-12-8-17(25-2)18(26-3)9-13(12)21-20(23)22(14)15(11)10-19(16)27-4/h7-10,14H,5-6H2,1-4H3,(H,21,23)
InChIKeyGREQXWPQNABTHP-UHFFFAOYSA-N
XLogP3.76
TPSA69.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6,7-dimethoxy-4-methyl-3-phenyl-1,4-dihydroquinazolin-2-one
CID 102384479
5-cyclopropyl-7,8-dimethoxy-3,4-dihydro-1H-1,5-benzodiazepin-2-one
CID 83008695
6,7-dimethoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid
CID 154209105
6,7-dimethoxy-1,3-dimethyl-3,4-dihydroquinoxalin-2-one
CID 82157443
6,7-dimethoxy-3-phenyl-4-propyl-1,4-dihydroquinazolin-2-one
CID 102384481
3-[(1R,2R)-2-hydroxycyclohexyl]-6,7-dimethoxy-1,4-dihydroquinazolin-2-one
CID 139796327
8,9-dimethoxy-1,2,3,4,4a,6-hexahydropyrazino[1,2-a]quinoxalin-5-one
CID 80502449
1-chloro-5,6-dimethoxy-2,3-dihydro-1H-indene
CID 82024117
(1S,11R)-4,5-dimethoxy-10,15-diazatetracyclo[8.7.0.02,7.011,15]heptadeca-2,4,6-trien-16-one
CID 10990303
4-(4-chlorophenyl)-6,7-dimethoxy-3-phenyl-1,4-dihydroquinazolin-2-one
CID 102384485
(2S)-2-(2,4,5-trimethoxyphenyl)cyclobutan-1-one
CID 125470187
[(13S,21S)-20-acetyl-16,17-dimethoxy-21-methyl-5,7-dioxa-1,20-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-2,4(8),9,14,16,18-hexaen-21-yl] acetate
CID 100883355

Frequently Asked Questions

What is the IUPAC name of 2,3,9,10-tetramethoxy-7,11b,12,13-tetrahydroquinolino[1,2-c]quinazolin-6-one?
The IUPAC name of 2,3,9,10-tetramethoxy-7,11b,12,13-tetrahydroquinolino[1,2-c]quinazolin-6-one (CID 12693390) is 2,3,9,10-tetramethoxy-7,11b,12,13-tetrahydroquinolino[1,2-c]quinazolin-6-one.
What is the SMILES notation for 2,3,9,10-tetramethoxy-7,11b,12,13-tetrahydroquinolino[1,2-c]quinazolin-6-one?
The canonical SMILES for 2,3,9,10-tetramethoxy-7,11b,12,13-tetrahydroquinolino[1,2-c]quinazolin-6-one is COc1cc2c(cc1OC)N1C(=O)Nc3cc(OC)c(OC)cc3C1CC2.
What is the InChIKey of 2,3,9,10-tetramethoxy-7,11b,12,13-tetrahydroquinolino[1,2-c]quinazolin-6-one?
The InChIKey is GREQXWPQNABTHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O5/c1-24-16-7-11-5-6-14-12-8-17(25-2)18(26-3)9-13(12)21-20(23)22(14)15(11)10-19(16)27-4/h7-10,14H,5-6H2,1-4H3,(H,21,23).
What are the key properties of 2,3,9,10-tetramethoxy-7,11b,12,13-tetrahydroquinolino[1,2-c]quinazolin-6-one?
2,3,9,10-tetramethoxy-7,11b,12,13-tetrahydroquinolino[1,2-c]quinazolin-6-one has a molecular weight of 370.41 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,9,10-tetramethoxy-7,11b,12,13-tetrahydroquinolino[1,2-c]quinazolin-6-one is sourced from PubChem (CID 12693390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).