About 6-N-(3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]oxazol-2-yl)-4-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazoline-4,6-diamine;4-N-[4-[(5-chloro-3-pyridinyl)oxy]-3-methylphenyl]-6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-[4-[(5-fluoro-3-pyridinyl)oxy]-3-methylphenyl]quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-(3-methyl-4-pyridin-3-yloxyphenyl)quinazoline-4,6-diamine;6-N-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-yl)-4-N-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]quinazoline-4,6-diamine
6-N-(3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]oxazol-2-yl)-4-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazoline-4,6-diamine;4-N-[4-[(5-chloro-3-pyridinyl)oxy]-3-methylphenyl]-6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-[4-[(5-fluoro-3-pyridinyl)oxy]-3-methylphenyl]quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-(3-methyl-4-pyridin-3-yloxyphenyl)quinazoline-4,6-diamine;6-N-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-yl)-4-N-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]quinazoline-4,6-diamine (PubChem CID 158738480) has the molecular formula C128H119Cl2FN30O12
and a molecular weight of 2359.46 g/mol. Its IUPAC name is 6-N-(3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]oxazol-2-yl)-4-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazoline-4,6-diamine;4-N-[4-[(5-chloro-3-pyridinyl)oxy]-3-methylphenyl]-6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-[4-[(5-fluoro-3-pyridinyl)oxy]-3-methylphenyl]quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-(3-methyl-4-pyridin-3-yloxyphenyl)quinazoline-4,6-diamine;6-N-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-yl)-4-N-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]quinazoline-4,6-diamine.
Frequently Asked Questions
What is the IUPAC name of 6-N-(3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]oxazol-2-yl)-4-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazoline-4,6-diamine;4-N-[4-[(5-chloro-3-pyridinyl)oxy]-3-methylphenyl]-6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-[4-[(5-fluoro-3-pyridinyl)oxy]-3-methylphenyl]quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-(3-methyl-4-pyridin-3-yloxyphenyl)quinazoline-4,6-diamine;6-N-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-yl)-4-N-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]quinazoline-4,6-diamine?
The IUPAC name of 6-N-(3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]oxazol-2-yl)-4-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazoline-4,6-diamine;4-N-[4-[(5-chloro-3-pyridinyl)oxy]-3-methylphenyl]-6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-[4-[(5-fluoro-3-pyridinyl)oxy]-3-methylphenyl]quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-(3-methyl-4-pyridin-3-yloxyphenyl)quinazoline-4,6-diamine;6-N-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-yl)-4-N-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]quinazoline-4,6-diamine (CID 158738480) is 6-N-(3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]oxazol-2-yl)-4-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazoline-4,6-diamine;4-N-[4-[(5-chloro-3-pyridinyl)oxy]-3-methylphenyl]-6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-[4-[(5-fluoro-3-pyridinyl)oxy]-3-methylphenyl]quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-(3-methyl-4-pyridin-3-yloxyphenyl)quinazoline-4,6-diamine;6-N-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-yl)-4-N-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]quinazoline-4,6-diamine.
What is the SMILES notation for 6-N-(3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]oxazol-2-yl)-4-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazoline-4,6-diamine;4-N-[4-[(5-chloro-3-pyridinyl)oxy]-3-methylphenyl]-6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-[4-[(5-fluoro-3-pyridinyl)oxy]-3-methylphenyl]quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-(3-methyl-4-pyridin-3-yloxyphenyl)quinazoline-4,6-diamine;6-N-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-yl)-4-N-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]quinazoline-4,6-diamine?
The canonical SMILES for 6-N-(3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]oxazol-2-yl)-4-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazoline-4,6-diamine;4-N-[4-[(5-chloro-3-pyridinyl)oxy]-3-methylphenyl]-6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-[4-[(5-fluoro-3-pyridinyl)oxy]-3-methylphenyl]quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-(3-methyl-4-pyridin-3-yloxyphenyl)quinazoline-4,6-diamine;6-N-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-yl)-4-N-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]quinazoline-4,6-diamine is Cc1cc(Nc2ncnc3ccc(NC4=NC(C)(C)CO4)cc23)ccc1Oc1cccnc1.Cc1cc(Nc2ncnc3ccc(NC4=NC(C)(C)CO4)cc23)ccc1Oc1cncc(Cl)c1.Cc1cc(Nc2ncnc3ccc(NC4=NC(C)(C)CO4)cc23)ccc1Oc1cncc(F)c1.Cc1ccc(Oc2ccc(Nc3ncnc4ccc(NC5=NCC6(CCOCC6)O5)cc34)cc2C)cn1.Clc1cc(Nc2ncnc3ccc(NC4=NC5COCC5O4)cc23)ccc1OCc1ccccn1.
What is the InChIKey of 6-N-(3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]oxazol-2-yl)-4-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazoline-4,6-diamine;4-N-[4-[(5-chloro-3-pyridinyl)oxy]-3-methylphenyl]-6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-[4-[(5-fluoro-3-pyridinyl)oxy]-3-methylphenyl]quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-(3-methyl-4-pyridin-3-yloxyphenyl)quinazoline-4,6-diamine;6-N-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-yl)-4-N-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]quinazoline-4,6-diamine?
The InChIKey is ILZFVNRLRFBISI-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H28N6O3.C25H21ClN6O3.C25H23ClN6O2.C25H23FN6O2.C25H24N6O2/c1-18-13-20(5-8-25(18)36-22-6-3-19(2)29-15-22)33-26-23-14-21(4-7-24(23)31-17-32-26)34-27-30-16-28(37-27)9-11-35-12-10-28;26-19-10-16(5-7-22(19)34-11-17-3-1-2-8-27-17)30-24-18-9-15(4-6-20(18)28-14-29-24)31-25-32-21-12-33-13-23(21)35-25;2*1-15-8-17(5-7-22(15)34-19-9-16(26)11-27-12-19)30-23-20-10-18(4-6-21(20)28-14-29-23)31-24-32-25(2,3)13-33-24;1-16-11-17(7-9-22(16)33-19-5-4-10-26-13-19)29-23-20-12-18(6-8-21(20)27-15-28-23)30-24-31-25(2,3)14-32-24/h3-8,13-15,17H,9-12,16H2,1-2H3,(H,30,34)(H,31,32,33);1-10,14,21,23H,11-13H2,(H,31,32)(H,28,29,30);2*4-12,14H,13H2,1-3H3,(H,31,32)(H,28,29,30);4-13,15H,14H2,1-3H3,(H,30,31)(H,27,28,29).
What are the key properties of 6-N-(3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]oxazol-2-yl)-4-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazoline-4,6-diamine;4-N-[4-[(5-chloro-3-pyridinyl)oxy]-3-methylphenyl]-6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-[4-[(5-fluoro-3-pyridinyl)oxy]-3-methylphenyl]quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-(3-methyl-4-pyridin-3-yloxyphenyl)quinazoline-4,6-diamine;6-N-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-yl)-4-N-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]quinazoline-4,6-diamine?
6-N-(3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]oxazol-2-yl)-4-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazoline-4,6-diamine;4-N-[4-[(5-chloro-3-pyridinyl)oxy]-3-methylphenyl]-6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-[4-[(5-fluoro-3-pyridinyl)oxy]-3-methylphenyl]quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-(3-methyl-4-pyridin-3-yloxyphenyl)quinazoline-4,6-diamine;6-N-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-yl)-4-N-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]quinazoline-4,6-diamine has a molecular weight of 2359.46 g/mol, XLogP of 27.22, 26 rotatable bonds, 10 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]oxazol-2-yl)-4-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazoline-4,6-diamine;4-N-[4-[(5-chloro-3-pyridinyl)oxy]-3-methylphenyl]-6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-[4-[(5-fluoro-3-pyridinyl)oxy]-3-methylphenyl]quinazoline-4,6-diamine;6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-(3-methyl-4-pyridin-3-yloxyphenyl)quinazoline-4,6-diamine;6-N-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-yl)-4-N-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]quinazoline-4,6-diamine is sourced from PubChem (CID 158738480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).