6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine;6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine;N-[3-chloro-4-[(3-methylphenyl)methoxy]phenyl]-6-[(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine

C128H115Cl5N26O11S2 — CID 157440242

IUPAC6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine;6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine;N-[3-chloro-4-[(3-methylphenyl)methoxy]phenyl]-6-[(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine
SMILESCC1CN=C(Cc2ccc3ncnc(Nc4ccc(OCc5ccccn5)c(Cl)c4)c3c2)O1.Cc1cccc(COc2ccc(Nc3ncnc4ccc(CC5=NC(C)CO5)cc34)cc2Cl)c1.Clc1cc(Nc2ncnc3ccc(CC4=NC5CNCC5O4)cc23)ccc1OCc1ccccn1.Clc1cc(Nc2ncnc3ccc(CC4=NC5CNCC5O4)cc23)ccc1OCc1nccs1.Clc1cc(Nc2ncnc3ccc(CC4=NCC5(CCOCC5)O4)cc23)ccc1OCc1nccs1
InChIInChI=1S/C27H25ClN4O2.C26H23ClN6O2.C26H24ClN5O3S.C25H22ClN5O2.C24H21ClN6O2S/c1-17-4-3-5-20(10-17)15-33-25-9-7-21(13-23(25)28)32-27-22-11-19(6-8-24(22)29-16-30-27)12-26-31-18(2)14-34-26;27-20-11-17(5-7-23(20)34-14-18-3-1-2-8-29-18)32-26-19-9-16(4-6-21(19)30-15-31-26)10-25-33-22-12-28-13-24(22)35-25;27-20-13-18(2-4-22(20)34-14-24-28-7-10-36-24)32-25-19-11-17(1-3-21(19)30-16-31-25)12-23-29-15-26(35-23)5-8-33-9-6-26;1-16-13-28-24(33-16)11-17-5-7-22-20(10-17)25(30-15-29-22)31-18-6-8-23(21(26)12-18)32-14-19-4-2-3-9-27-19;25-17-9-15(2-4-20(17)32-12-23-27-5-6-34-23)30-24-16-7-14(1-3-18(16)28-13-29-24)8-22-31-19-10-26-11-21(19)33-22/h3-11,13,16,18H,12,14-15H2,1-2H3,(H,29,30,32);1-9,11,15,22,24,28H,10,12-14H2,(H,30,31,32);1-4,7,10-11,13,16H,5-6,8-9,12,14-15H2,(H,30,31,32);2-10,12,15-16H,11,13-14H2,1H3,(H,29,30,31);1-7,9,13,19,21,26H,8,10-12H2,(H,28,29,30)
InChIKeyBROZYYVIOYUMNR-UHFFFAOYSA-N
MW2434.90 g/mol
LogP25.90
Rot. Bonds35

About 6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine;6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine;N-[3-chloro-4-[(3-methylphenyl)methoxy]phenyl]-6-[(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine

6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine;6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine;N-[3-chloro-4-[(3-methylphenyl)methoxy]phenyl]-6-[(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine (PubChem CID 157440242) has the molecular formula C128H115Cl5N26O11S2 and a molecular weight of 2434.90 g/mol. Its IUPAC name is 6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine;6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine;N-[3-chloro-4-[(3-methylphenyl)methoxy]phenyl]-6-[(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine.

Molecular Properties

Compound Name6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine;6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine;N-[3-chloro-4-[(3-methylphenyl)methoxy]phenyl]-6-[(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine
PubChem CID157440242
Molecular FormulaC128H115Cl5N26O11S2
Molecular Weight2434.90 g/mol
Exact Mass2430.71
IUPAC Name6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine;6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine;N-[3-chloro-4-[(3-methylphenyl)methoxy]phenyl]-6-[(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine
SMILESCC1CN=C(Cc2ccc3ncnc(Nc4ccc(OCc5ccccn5)c(Cl)c4)c3c2)O1.Cc1cccc(COc2ccc(Nc3ncnc4ccc(CC5=NC(C)CO5)cc34)cc2Cl)c1.Clc1cc(Nc2ncnc3ccc(CC4=NC5CNCC5O4)cc23)ccc1OCc1ccccn1.Clc1cc(Nc2ncnc3ccc(CC4=NC5CNCC5O4)cc23)ccc1OCc1nccs1.Clc1cc(Nc2ncnc3ccc(CC4=NCC5(CCOCC5)O4)cc23)ccc1OCc1nccs1
InChIInChI=1S/C27H25ClN4O2.C26H23ClN6O2.C26H24ClN5O3S.C25H22ClN5O2.C24H21ClN6O2S/c1-17-4-3-5-20(10-17)15-33-25-9-7-21(13-23(25)28)32-27-22-11-19(6-8-24(22)29-16-30-27)12-26-31-18(2)14-34-26;27-20-11-17(5-7-23(20)34-14-18-3-1-2-8-29-18)32-26-19-9-16(4-6-21(19)30-15-31-26)10-25-33-22-12-28-13-24(22)35-25;27-20-13-18(2-4-22(20)34-14-24-28-7-10-36-24)32-25-19-11-17(1-3-21(19)30-16-31-25)12-23-29-15-26(35-23)5-8-33-9-6-26;1-16-13-28-24(33-16)11-17-5-7-22-20(10-17)25(30-15-29-22)31-18-6-8-23(21(26)12-18)32-14-19-4-2-3-9-27-19;25-17-9-15(2-4-20(17)32-12-23-27-5-6-34-23)30-24-16-7-14(1-3-18(16)28-13-29-24)8-22-31-19-10-26-11-21(19)33-22/h3-11,13,16,18H,12,14-15H2,1-2H3,(H,29,30,32);1-9,11,15,22,24,28H,10,12-14H2,(H,30,31,32);1-4,7,10-11,13,16H,5-6,8-9,12,14-15H2,(H,30,31,32);2-10,12,15-16H,11,13-14H2,1H3,(H,29,30,31);1-7,9,13,19,21,26H,8,10-12H2,(H,28,29,30)
InChIKeyBROZYYVIOYUMNR-UHFFFAOYSA-N
XLogP25.90
TPSA428.00 Ų
H-Bond Donors7
H-Bond Acceptors39
Rotatable Bonds35
Heavy Atoms172
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002434.90
LogP ≤ 525.90
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1039

Analyze 6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine;6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine;N-[3-chloro-4-[(3-methylphenyl)methoxy]phenyl]-6-[(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine with MolForge

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Launch Full Analysis

Related Compounds

N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[2-[1-(2-pyridin-2-yl-1-sulfonylethoxy)propyl]-1,3-thiazol-4-yl]quinazolin-4-amine
CID 22017694
N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[2-[1-(2-pyridin-2-yl-1-sulfonylethoxy)ethyl]-1,3-thiazol-4-yl]quinazolin-4-amine
CID 22018218
4-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-N-[(5S)-5-methyl-4,5-dihydro-1,3-oxazol-2-yl]quinazoline-4,6-diamine;4-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-N-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]quinazoline-4,6-diamine
CID 87394560
N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]quinazolin-4-amine
CID 141432153
N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-(2-piperidin-1-yl-1,3-thiazol-5-yl)quinazolin-4-amine;tetrahydrochloride
CID 141432155
N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine
CID 147397159
N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-[(4,4-dimethyl-5H-1,3-oxazol-2-yl)methyl]quinazolin-4-amine
CID 147999157
6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine
CID 149372577
N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-[[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]methyl]quinazolin-4-amine
CID 152842448
N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(4,5-dihydro-1,3-oxazol-2-ylmethyl)quinazolin-4-amine
CID 152859736
N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine
CID 153164683
(3aR,5R,6aS)-2-[[4-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]anilino]quinazolin-6-yl]methyl]-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazol-5-ol;[2-[[4-[3-chloro-4-[(3-fluorophenyl)methoxy]anilino]quinazolin-6-yl]methyl]-4-(hydroxymethyl)-5H-1,3-oxazol-4-yl]methanol;(1S)-1-[(5S)-2-[[4-[3-chloro-4-[(3-fluorophenyl)methoxy]anilino]quinazolin-6-yl]methyl]-5-methyl-4H-1,3-oxazol-5-yl]ethanol;(1S)-1-[2-[[4-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)anilino]quinazolin-6-yl]methyl]-5-methyl-4H-1,3-oxazol-5-yl]ethanol;(1R)-1-[(5S)-2-[[4-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)anilino]quinazolin-6-yl]methyl]-5-methyl-4H-1,3-oxazol-5-yl]ethanol
CID 157160926

Frequently Asked Questions

What is the IUPAC name of 6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine;6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine;N-[3-chloro-4-[(3-methylphenyl)methoxy]phenyl]-6-[(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine?
The IUPAC name of 6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine;6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine;N-[3-chloro-4-[(3-methylphenyl)methoxy]phenyl]-6-[(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine (CID 157440242) is 6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine;6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine;N-[3-chloro-4-[(3-methylphenyl)methoxy]phenyl]-6-[(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine.
What is the SMILES notation for 6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine;6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine;N-[3-chloro-4-[(3-methylphenyl)methoxy]phenyl]-6-[(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine?
The canonical SMILES for 6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine;6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine;N-[3-chloro-4-[(3-methylphenyl)methoxy]phenyl]-6-[(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine is CC1CN=C(Cc2ccc3ncnc(Nc4ccc(OCc5ccccn5)c(Cl)c4)c3c2)O1.Cc1cccc(COc2ccc(Nc3ncnc4ccc(CC5=NC(C)CO5)cc34)cc2Cl)c1.Clc1cc(Nc2ncnc3ccc(CC4=NC5CNCC5O4)cc23)ccc1OCc1ccccn1.Clc1cc(Nc2ncnc3ccc(CC4=NC5CNCC5O4)cc23)ccc1OCc1nccs1.Clc1cc(Nc2ncnc3ccc(CC4=NCC5(CCOCC5)O4)cc23)ccc1OCc1nccs1.
What is the InChIKey of 6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine;6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine;N-[3-chloro-4-[(3-methylphenyl)methoxy]phenyl]-6-[(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine?
The InChIKey is BROZYYVIOYUMNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H25ClN4O2.C26H23ClN6O2.C26H24ClN5O3S.C25H22ClN5O2.C24H21ClN6O2S/c1-17-4-3-5-20(10-17)15-33-25-9-7-21(13-23(25)28)32-27-22-11-19(6-8-24(22)29-16-30-27)12-26-31-18(2)14-34-26;27-20-11-17(5-7-23(20)34-14-18-3-1-2-8-29-18)32-26-19-9-16(4-6-21(19)30-15-31-26)10-25-33-22-12-28-13-24(22)35-25;27-20-13-18(2-4-22(20)34-14-24-28-7-10-36-24)32-25-19-11-17(1-3-21(19)30-16-31-25)12-23-29-15-26(35-23)5-8-33-9-6-26;1-16-13-28-24(33-16)11-17-5-7-22-20(10-17)25(30-15-29-22)31-18-6-8-23(21(26)12-18)32-14-19-4-2-3-9-27-19;25-17-9-15(2-4-20(17)32-12-23-27-5-6-34-23)30-24-16-7-14(1-3-18(16)28-13-29-24)8-22-31-19-10-26-11-21(19)33-22/h3-11,13,16,18H,12,14-15H2,1-2H3,(H,29,30,32);1-9,11,15,22,24,28H,10,12-14H2,(H,30,31,32);1-4,7,10-11,13,16H,5-6,8-9,12,14-15H2,(H,30,31,32);2-10,12,15-16H,11,13-14H2,1H3,(H,29,30,31);1-7,9,13,19,21,26H,8,10-12H2,(H,28,29,30).
What are the key properties of 6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine;6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine;N-[3-chloro-4-[(3-methylphenyl)methoxy]phenyl]-6-[(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine?
6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine;6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine;N-[3-chloro-4-[(3-methylphenyl)methoxy]phenyl]-6-[(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine has a molecular weight of 2434.90 g/mol, XLogP of 25.90, 35 rotatable bonds, 7 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine;6-(4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]oxazol-2-ylmethyl)-N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]quinazolin-4-amine;N-[3-chloro-4-[(3-methylphenyl)methoxy]phenyl]-6-[(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-6-[(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)methyl]quinazolin-4-amine;N-[3-chloro-4-(1,3-thiazol-2-ylmethoxy)phenyl]-6-(1,8-dioxa-3-azaspiro[4.5]dec-2-en-2-ylmethyl)quinazolin-4-amine is sourced from PubChem (CID 157440242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).