8-chloro-2-cyclopropyl-4-methoxy-7-methylquinazoline;8-chloro-2-cyclopropyloxy-4-methoxy-7-methylquinazoline;8-chloro-2,4-dimethoxy-7-methylquinazoline;8-chloro-2-ethoxy-4-methoxy-7-methylquinazoline;8-chloro-4-methoxy-7-methyl-2-phenylquinazoline;8-chloro-4-methoxy-7-methyl-2-pyridin-4-ylquinazoline;8-chloro-4-methoxy-7-methyl-2-(2,2,2-trifluoroethoxy)quinazoline;1-methoxy-6,7-dimethyl-3-phenylisoquinoline

C110H102Cl7F3N16O12 — CID 157414298

About 8-chloro-2-cyclopropyl-4-methoxy-7-methylquinazoline;8-chloro-2-cyclopropyloxy-4-methoxy-7-methylquinazoline;8-chloro-2,4-dimethoxy-7-methylquinazoline;8-chloro-2-ethoxy-4-methoxy-7-methylquinazoline;8-chloro-4-methoxy-7-methyl-2-phenylquinazoline;8-chloro-4-methoxy-7-methyl-2-pyridin-4-ylquinazoline;8-chloro-4-methoxy-7-methyl-2-(2,2,2-trifluoroethoxy)quinazoline;1-methoxy-6,7-dimethyl-3-phenylisoquinoline

8-chloro-2-cyclopropyl-4-methoxy-7-methylquinazoline;8-chloro-2-cyclopropyloxy-4-methoxy-7-methylquinazoline;8-chloro-2,4-dimethoxy-7-methylquinazoline;8-chloro-2-ethoxy-4-methoxy-7-methylquinazoline;8-chloro-4-methoxy-7-methyl-2-phenylquinazoline;8-chloro-4-methoxy-7-methyl-2-pyridin-4-ylquinazoline;8-chloro-4-methoxy-7-methyl-2-(2,2,2-trifluoroethoxy)quinazoline;1-methoxy-6,7-dimethyl-3-phenylisoquinoline (PubChem CID 157414298) has the molecular formula C110H102Cl7F3N16O12 and a molecular weight of 2145.29 g/mol. Its IUPAC name is 8-chloro-2-cyclopropyl-4-methoxy-7-methylquinazoline;8-chloro-2-cyclopropyloxy-4-methoxy-7-methylquinazoline;8-chloro-2,4-dimethoxy-7-methylquinazoline;8-chloro-2-ethoxy-4-methoxy-7-methylquinazoline;8-chloro-4-methoxy-7-methyl-2-phenylquinazoline;8-chloro-4-methoxy-7-methyl-2-pyridin-4-ylquinazoline;8-chloro-4-methoxy-7-methyl-2-(2,2,2-trifluoroethoxy)quinazoline;1-methoxy-6,7-dimethyl-3-phenylisoquinoline.

Molecular Properties

• Compound Name: 8-chloro-2-cyclopropyl-4-methoxy-7-methylquinazoline;8-chloro-2-cyclopropyloxy-4-methoxy-7-methylquinazoline;8-chloro-2,4-dimethoxy-7-methylquinazoline;8-chloro-2-ethoxy-4-methoxy-7-methylquinazoline;8-chloro-4-methoxy-7-methyl-2-phenylquinazoline;8-chloro-4-methoxy-7-methyl-2-pyridin-4-ylquinazoline;8-chloro-4-methoxy-7-methyl-2-(2,2,2-trifluoroethoxy)quinazoline;1-methoxy-6,7-dimethyl-3-phenylisoquinoline
• PubChem CID: 157414298
• Molecular Formula: C110H102Cl7F3N16O12
• Molecular Weight: 2145.29 g/mol
• Exact Mass: 2140.56
• IUPAC Name: 8-chloro-2-cyclopropyl-4-methoxy-7-methylquinazoline;8-chloro-2-cyclopropyloxy-4-methoxy-7-methylquinazoline;8-chloro-2,4-dimethoxy-7-methylquinazoline;8-chloro-2-ethoxy-4-methoxy-7-methylquinazoline;8-chloro-4-methoxy-7-methyl-2-phenylquinazoline;8-chloro-4-methoxy-7-methyl-2-pyridin-4-ylquinazoline;8-chloro-4-methoxy-7-methyl-2-(2,2,2-trifluoroethoxy)quinazoline;1-methoxy-6,7-dimethyl-3-phenylisoquinoline
• SMILES: CCOc1nc(OC)c2ccc(C)c(Cl)c2n1.COc1nc(-c2ccccc2)cc2cc(C)c(C)cc12.COc1nc(-c2ccccc2)nc2c(Cl)c(C)ccc12.COc1nc(-c2ccncc2)nc2c(Cl)c(C)ccc12.COc1nc(C2CC2)nc2c(Cl)c(C)ccc12.COc1nc(OC)c2ccc(C)c(Cl)c2n1.COc1nc(OC2CC2)nc2c(Cl)c(C)ccc12.COc1nc(OCC(F)(F)F)nc2c(Cl)c(C)ccc12
• InChI: InChI=1S/C18H17NO.C16H13ClN2O.C15H12ClN3O.C13H13ClN2O2.C13H13ClN2O.C12H10ClF3N2O2.C12H13ClN2O2.C11H11ClN2O2/c1-12-9-15-11-17(14-7-5-4-6-8-14)19-18(20-3)16(15)10-13(12)2;1-10-8-9-12-14(13(10)17)18-15(19-16(12)20-2)11-6-4-3-5-7-11;1-9-3-4-11-13(12(9)16)18-14(19-15(11)20-2)10-5-7-17-8-6-10;1-7-3-6-9-11(10(7)14)15-13(16-12(9)17-2)18-8-4-5-8;1-7-3-6-9-11(10(7)14)15-12(8-4-5-8)16-13(9)17-2;1-6-3-4-7-9(8(6)13)17-11(18-10(7)19-2)20-5-12(14,15)16;1-4-17-12-14-10-8(11(15-12)16-3)6-5-7(2)9(10)13;1-6-4-5-7-9(8(6)12)13-11(16-3)14-10(7)15-2/h4-11H,1-3H3;3-9H,1-2H3;3-8H,1-2H3;3,6,8H,4-5H2,1-2H3;3,6,8H,4-5H2,1-2H3;3-4H,5H2,1-2H3;5-6H,4H2,1-3H3;4-5H,1-3H3
• InChIKey: BOQUNQLPMLMQGM-UHFFFAOYSA-N
• XLogP: 28.22
• TPSA: 317.00 Ų
• H-Bond Acceptors: 28
• Rotatable Bonds: 19
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2145.29
LogP ≤ 5	28.22
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	28

Frequently Asked Questions

What is the IUPAC name of 8-chloro-2-cyclopropyl-4-methoxy-7-methylquinazoline;8-chloro-2-cyclopropyloxy-4-methoxy-7-methylquinazoline;8-chloro-2,4-dimethoxy-7-methylquinazoline;8-chloro-2-ethoxy-4-methoxy-7-methylquinazoline;8-chloro-4-methoxy-7-methyl-2-phenylquinazoline;8-chloro-4-methoxy-7-methyl-2-pyridin-4-ylquinazoline;8-chloro-4-methoxy-7-methyl-2-(2,2,2-trifluoroethoxy)quinazoline;1-methoxy-6,7-dimethyl-3-phenylisoquinoline?

The IUPAC name of 8-chloro-2-cyclopropyl-4-methoxy-7-methylquinazoline;8-chloro-2-cyclopropyloxy-4-methoxy-7-methylquinazoline;8-chloro-2,4-dimethoxy-7-methylquinazoline;8-chloro-2-ethoxy-4-methoxy-7-methylquinazoline;8-chloro-4-methoxy-7-methyl-2-phenylquinazoline;8-chloro-4-methoxy-7-methyl-2-pyridin-4-ylquinazoline;8-chloro-4-methoxy-7-methyl-2-(2,2,2-trifluoroethoxy)quinazoline;1-methoxy-6,7-dimethyl-3-phenylisoquinoline (CID 157414298) is 8-chloro-2-cyclopropyl-4-methoxy-7-methylquinazoline;8-chloro-2-cyclopropyloxy-4-methoxy-7-methylquinazoline;8-chloro-2,4-dimethoxy-7-methylquinazoline;8-chloro-2-ethoxy-4-methoxy-7-methylquinazoline;8-chloro-4-methoxy-7-methyl-2-phenylquinazoline;8-chloro-4-methoxy-7-methyl-2-pyridin-4-ylquinazoline;8-chloro-4-methoxy-7-methyl-2-(2,2,2-trifluoroethoxy)quinazoline;1-methoxy-6,7-dimethyl-3-phenylisoquinoline.

What is the SMILES notation for 8-chloro-2-cyclopropyl-4-methoxy-7-methylquinazoline;8-chloro-2-cyclopropyloxy-4-methoxy-7-methylquinazoline;8-chloro-2,4-dimethoxy-7-methylquinazoline;8-chloro-2-ethoxy-4-methoxy-7-methylquinazoline;8-chloro-4-methoxy-7-methyl-2-phenylquinazoline;8-chloro-4-methoxy-7-methyl-2-pyridin-4-ylquinazoline;8-chloro-4-methoxy-7-methyl-2-(2,2,2-trifluoroethoxy)quinazoline;1-methoxy-6,7-dimethyl-3-phenylisoquinoline?

The canonical SMILES for 8-chloro-2-cyclopropyl-4-methoxy-7-methylquinazoline;8-chloro-2-cyclopropyloxy-4-methoxy-7-methylquinazoline;8-chloro-2,4-dimethoxy-7-methylquinazoline;8-chloro-2-ethoxy-4-methoxy-7-methylquinazoline;8-chloro-4-methoxy-7-methyl-2-phenylquinazoline;8-chloro-4-methoxy-7-methyl-2-pyridin-4-ylquinazoline;8-chloro-4-methoxy-7-methyl-2-(2,2,2-trifluoroethoxy)quinazoline;1-methoxy-6,7-dimethyl-3-phenylisoquinoline is CCOc1nc(OC)c2ccc(C)c(Cl)c2n1.COc1nc(-c2ccccc2)cc2cc(C)c(C)cc12.COc1nc(-c2ccccc2)nc2c(Cl)c(C)ccc12.COc1nc(-c2ccncc2)nc2c(Cl)c(C)ccc12.COc1nc(C2CC2)nc2c(Cl)c(C)ccc12.COc1nc(OC)c2ccc(C)c(Cl)c2n1.COc1nc(OC2CC2)nc2c(Cl)c(C)ccc12.COc1nc(OCC(F)(F)F)nc2c(Cl)c(C)ccc12.

What is the InChIKey of 8-chloro-2-cyclopropyl-4-methoxy-7-methylquinazoline;8-chloro-2-cyclopropyloxy-4-methoxy-7-methylquinazoline;8-chloro-2,4-dimethoxy-7-methylquinazoline;8-chloro-2-ethoxy-4-methoxy-7-methylquinazoline;8-chloro-4-methoxy-7-methyl-2-phenylquinazoline;8-chloro-4-methoxy-7-methyl-2-pyridin-4-ylquinazoline;8-chloro-4-methoxy-7-methyl-2-(2,2,2-trifluoroethoxy)quinazoline;1-methoxy-6,7-dimethyl-3-phenylisoquinoline?

The InChIKey is BOQUNQLPMLMQGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO.C16H13ClN2O.C15H12ClN3O.C13H13ClN2O2.C13H13ClN2O.C12H10ClF3N2O2.C12H13ClN2O2.C11H11ClN2O2/c1-12-9-15-11-17(14-7-5-4-6-8-14)19-18(20-3)16(15)10-13(12)2;1-10-8-9-12-14(13(10)17)18-15(19-16(12)20-2)11-6-4-3-5-7-11;1-9-3-4-11-13(12(9)16)18-14(19-15(11)20-2)10-5-7-17-8-6-10;1-7-3-6-9-11(10(7)14)15-13(16-12(9)17-2)18-8-4-5-8;1-7-3-6-9-11(10(7)14)15-12(8-4-5-8)16-13(9)17-2;1-6-3-4-7-9(8(6)13)17-11(18-10(7)19-2)20-5-12(14,15)16;1-4-17-12-14-10-8(11(15-12)16-3)6-5-7(2)9(10)13;1-6-4-5-7-9(8(6)12)13-11(16-3)14-10(7)15-2/h4-11H,1-3H3;3-9H,1-2H3;3-8H,1-2H3;3,6,8H,4-5H2,1-2H3;3,6,8H,4-5H2,1-2H3;3-4H,5H2,1-2H3;5-6H,4H2,1-3H3;4-5H,1-3H3.

What are the key properties of 8-chloro-2-cyclopropyl-4-methoxy-7-methylquinazoline;8-chloro-2-cyclopropyloxy-4-methoxy-7-methylquinazoline;8-chloro-2,4-dimethoxy-7-methylquinazoline;8-chloro-2-ethoxy-4-methoxy-7-methylquinazoline;8-chloro-4-methoxy-7-methyl-2-phenylquinazoline;8-chloro-4-methoxy-7-methyl-2-pyridin-4-ylquinazoline;8-chloro-4-methoxy-7-methyl-2-(2,2,2-trifluoroethoxy)quinazoline;1-methoxy-6,7-dimethyl-3-phenylisoquinoline?

8-chloro-2-cyclopropyl-4-methoxy-7-methylquinazoline;8-chloro-2-cyclopropyloxy-4-methoxy-7-methylquinazoline;8-chloro-2,4-dimethoxy-7-methylquinazoline;8-chloro-2-ethoxy-4-methoxy-7-methylquinazoline;8-chloro-4-methoxy-7-methyl-2-phenylquinazoline;8-chloro-4-methoxy-7-methyl-2-pyridin-4-ylquinazoline;8-chloro-4-methoxy-7-methyl-2-(2,2,2-trifluoroethoxy)quinazoline;1-methoxy-6,7-dimethyl-3-phenylisoquinoline has a molecular weight of 2145.29 g/mol, XLogP of 28.22, 19 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 8-chloro-2-cyclopropyl-4-methoxy-7-methylquinazoline;8-chloro-2-cyclopropyloxy-4-methoxy-7-methylquinazoline;8-chloro-2,4-dimethoxy-7-methylquinazoline;8-chloro-2-ethoxy-4-methoxy-7-methylquinazoline;8-chloro-4-methoxy-7-methyl-2-phenylquinazoline;8-chloro-4-methoxy-7-methyl-2-pyridin-4-ylquinazoline;8-chloro-4-methoxy-7-methyl-2-(2,2,2-trifluoroethoxy)quinazoline;1-methoxy-6,7-dimethyl-3-phenylisoquinoline is sourced from PubChem (CID 157414298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).