3-bromoaniline;1-bromo-3-(2-cyclopropylethyl)benzene;(3E)-N-(3-bromophenyl)-6-chloro-N-(cyclopropylmethyl)-3-hydrazinylidene-4H-isoquinolin-1-amine;N-(3-bromophenyl)-8-chloro-N-(cyclopropylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromophenyl)-2,7-dichloro-N-(cyclopropylmethyl)quinazolin-4-amine;8-chloro-N-(cyclopropylmethyl)-N-[3-[2-(1-methylcyclopropyl)ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;cyclopropanecarbaldehyde;diethoxymethoxyethane;1-ethynyl-1-methylcyclopropane;hydrazine;methane;2,4,7-trichloroquinazoline

C124H129Br5Cl8N22O4 — CID 172942356

IUPAC3-bromoaniline;1-bromo-3-(2-cyclopropylethyl)benzene;(3E)-N-(3-bromophenyl)-6-chloro-N-(cyclopropylmethyl)-3-hydrazinylidene-4H-isoquinolin-1-amine;N-(3-bromophenyl)-8-chloro-N-(cyclopropylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromophenyl)-2,7-dichloro-N-(cyclopropylmethyl)quinazolin-4-amine;8-chloro-N-(cyclopropylmethyl)-N-[3-[2-(1-methylcyclopropyl)ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;cyclopropanecarbaldehyde;diethoxymethoxyethane;1-ethynyl-1-methylcyclopropane;hydrazine;methane;2,4,7-trichloroquinazoline
SMILESBrc1cccc(CCC2CC2)c1.C.C#CC1(C)CC1.CC1(C#Cc2cccc(N(CC3CC3)c3nc4nncn4c4cc(Cl)ccc34)c2)CC1.CCOC(OCC)OCC.Clc1ccc2c(Cl)nc(Cl)nc2c1.Clc1ccc2c(N(CC3CC3)c3cccc(Br)c3)nc(Cl)nc2c1.Clc1ccc2c(N(CC3CC3)c3cccc(Br)c3)nc3nncn3c2c1.N/N=C1\Cc2cc(Cl)ccc2C(N(CC2CC2)c2cccc(Br)c2)=N1.NN.Nc1cccc(Br)c1.O=CC1CC1
InChIInChI=1S/C25H22ClN5.C19H15BrClN5.C19H18BrClN4.C18H14BrCl2N3.C11H13Br.C8H3Cl3N2.C7H16O3.C6H6BrN.C6H8.C4H6O.CH4.H4N2/c1-25(11-12-25)10-9-17-3-2-4-20(13-17)30(15-18-5-6-18)23-21-8-7-19(26)14-22(21)31-16-27-29-24(31)28-23;20-13-2-1-3-15(8-13)25(10-12-4-5-12)18-16-7-6-14(21)9-17(16)26-11-22-24-19(26)23-18;20-14-2-1-3-16(10-14)25(11-12-4-5-12)19-17-7-6-15(21)8-13(17)9-18(23-19)24-22;19-12-2-1-3-14(8-12)24(10-11-4-5-11)17-15-7-6-13(20)9-16(15)22-18(21)23-17;12-11-3-1-2-10(8-11)7-6-9-4-5-9;9-4-1-2-5-6(3-4)12-8(11)13-7(5)10;1-4-8-7(9-5-2)10-6-3;7-5-2-1-3-6(8)4-5;1-3-6(2)4-5-6;5-3-4-1-2-4;;1-2/h2-4,7-8,13-14,16,18H,5-6,11-12,15H2,1H3;1-3,6-9,11-12H,4-5,10H2;1-3,6-8,10,12H,4-5,9,11,22H2;1-3,6-9,11H,4-5,10H2;1-3,8-9H,4-7H2;1-3H;7H,4-6H2,1-3H3;1-4H,8H2;1H,4-5H2,2H3;3-4H,1-2H2;1H4;1-2H2/b;;24-18+;;;;;;;;;
InChIKeyVYYIVHFXJVHKCS-WXWJAHRZSA-N
MW2674.69 g/mol
LogP33.98
Rot. Bonds25

About 3-bromoaniline;1-bromo-3-(2-cyclopropylethyl)benzene;(3E)-N-(3-bromophenyl)-6-chloro-N-(cyclopropylmethyl)-3-hydrazinylidene-4H-isoquinolin-1-amine;N-(3-bromophenyl)-8-chloro-N-(cyclopropylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromophenyl)-2,7-dichloro-N-(cyclopropylmethyl)quinazolin-4-amine;8-chloro-N-(cyclopropylmethyl)-N-[3-[2-(1-methylcyclopropyl)ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;cyclopropanecarbaldehyde;diethoxymethoxyethane;1-ethynyl-1-methylcyclopropane;hydrazine;methane;2,4,7-trichloroquinazoline

3-bromoaniline;1-bromo-3-(2-cyclopropylethyl)benzene;(3E)-N-(3-bromophenyl)-6-chloro-N-(cyclopropylmethyl)-3-hydrazinylidene-4H-isoquinolin-1-amine;N-(3-bromophenyl)-8-chloro-N-(cyclopropylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromophenyl)-2,7-dichloro-N-(cyclopropylmethyl)quinazolin-4-amine;8-chloro-N-(cyclopropylmethyl)-N-[3-[2-(1-methylcyclopropyl)ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;cyclopropanecarbaldehyde;diethoxymethoxyethane;1-ethynyl-1-methylcyclopropane;hydrazine;methane;2,4,7-trichloroquinazoline (PubChem CID 172942356) has the molecular formula C124H129Br5Cl8N22O4 and a molecular weight of 2674.69 g/mol. Its IUPAC name is 3-bromoaniline;1-bromo-3-(2-cyclopropylethyl)benzene;(3E)-N-(3-bromophenyl)-6-chloro-N-(cyclopropylmethyl)-3-hydrazinylidene-4H-isoquinolin-1-amine;N-(3-bromophenyl)-8-chloro-N-(cyclopropylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromophenyl)-2,7-dichloro-N-(cyclopropylmethyl)quinazolin-4-amine;8-chloro-N-(cyclopropylmethyl)-N-[3-[2-(1-methylcyclopropyl)ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;cyclopropanecarbaldehyde;diethoxymethoxyethane;1-ethynyl-1-methylcyclopropane;hydrazine;methane;2,4,7-trichloroquinazoline.

Molecular Properties

Compound Name3-bromoaniline;1-bromo-3-(2-cyclopropylethyl)benzene;(3E)-N-(3-bromophenyl)-6-chloro-N-(cyclopropylmethyl)-3-hydrazinylidene-4H-isoquinolin-1-amine;N-(3-bromophenyl)-8-chloro-N-(cyclopropylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromophenyl)-2,7-dichloro-N-(cyclopropylmethyl)quinazolin-4-amine;8-chloro-N-(cyclopropylmethyl)-N-[3-[2-(1-methylcyclopropyl)ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;cyclopropanecarbaldehyde;diethoxymethoxyethane;1-ethynyl-1-methylcyclopropane;hydrazine;methane;2,4,7-trichloroquinazoline
PubChem CID172942356
Molecular FormulaC124H129Br5Cl8N22O4
Molecular Weight2674.69 g/mol
Exact Mass2664.40
IUPAC Name3-bromoaniline;1-bromo-3-(2-cyclopropylethyl)benzene;(3E)-N-(3-bromophenyl)-6-chloro-N-(cyclopropylmethyl)-3-hydrazinylidene-4H-isoquinolin-1-amine;N-(3-bromophenyl)-8-chloro-N-(cyclopropylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromophenyl)-2,7-dichloro-N-(cyclopropylmethyl)quinazolin-4-amine;8-chloro-N-(cyclopropylmethyl)-N-[3-[2-(1-methylcyclopropyl)ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;cyclopropanecarbaldehyde;diethoxymethoxyethane;1-ethynyl-1-methylcyclopropane;hydrazine;methane;2,4,7-trichloroquinazoline
SMILESBrc1cccc(CCC2CC2)c1.C.C#CC1(C)CC1.CC1(C#Cc2cccc(N(CC3CC3)c3nc4nncn4c4cc(Cl)ccc34)c2)CC1.CCOC(OCC)OCC.Clc1ccc2c(Cl)nc(Cl)nc2c1.Clc1ccc2c(N(CC3CC3)c3cccc(Br)c3)nc(Cl)nc2c1.Clc1ccc2c(N(CC3CC3)c3cccc(Br)c3)nc3nncn3c2c1.N/N=C1\Cc2cc(Cl)ccc2C(N(CC2CC2)c2cccc(Br)c2)=N1.NN.Nc1cccc(Br)c1.O=CC1CC1
InChIInChI=1S/C25H22ClN5.C19H15BrClN5.C19H18BrClN4.C18H14BrCl2N3.C11H13Br.C8H3Cl3N2.C7H16O3.C6H6BrN.C6H8.C4H6O.CH4.H4N2/c1-25(11-12-25)10-9-17-3-2-4-20(13-17)30(15-18-5-6-18)23-21-8-7-19(26)14-22(21)31-16-27-29-24(31)28-23;20-13-2-1-3-15(8-13)25(10-12-4-5-12)18-16-7-6-14(21)9-17(16)26-11-22-24-19(26)23-18;20-14-2-1-3-16(10-14)25(11-12-4-5-12)19-17-7-6-15(21)8-13(17)9-18(23-19)24-22;19-12-2-1-3-14(8-12)24(10-11-4-5-11)17-15-7-6-13(20)9-16(15)22-18(21)23-17;12-11-3-1-2-10(8-11)7-6-9-4-5-9;9-4-1-2-5-6(3-4)12-8(11)13-7(5)10;1-4-8-7(9-5-2)10-6-3;7-5-2-1-3-6(8)4-5;1-3-6(2)4-5-6;5-3-4-1-2-4;;1-2/h2-4,7-8,13-14,16,18H,5-6,11-12,15H2,1H3;1-3,6-9,11-12H,4-5,10H2;1-3,6-8,10,12H,4-5,9,11,22H2;1-3,6-9,11H,4-5,10H2;1-3,8-9H,4-7H2;1-3H;7H,4-6H2,1-3H3;1-4H,8H2;1H,4-5H2,2H3;3-4H,1-2H2;1H4;1-2H2/b;;24-18+;;;;;;;;;
InChIKeyVYYIVHFXJVHKCS-WXWJAHRZSA-N
XLogP33.98
TPSA324.24 Ų
H-Bond Donors4
H-Bond Acceptors25
Rotatable Bonds25
Heavy Atoms163
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002674.69
LogP ≤ 533.98
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}

Analyze 3-bromoaniline;1-bromo-3-(2-cyclopropylethyl)benzene;(3E)-N-(3-bromophenyl)-6-chloro-N-(cyclopropylmethyl)-3-hydrazinylidene-4H-isoquinolin-1-amine;N-(3-bromophenyl)-8-chloro-N-(cyclopropylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromophenyl)-2,7-dichloro-N-(cyclopropylmethyl)quinazolin-4-amine;8-chloro-N-(cyclopropylmethyl)-N-[3-[2-(1-methylcyclopropyl)ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;cyclopropanecarbaldehyde;diethoxymethoxyethane;1-ethynyl-1-methylcyclopropane;hydrazine;methane;2,4,7-trichloroquinazoline with MolForge

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Launch Full Analysis

Related Compounds

N-aminohydroxylamine;2-bromo-4-ethylpyridine;N-(2-bromo-4-pyridinyl)-7-chloro-2-hydrazinyl-N-methylquinazolin-4-amine;N-(2-bromo-4-pyridinyl)-8-chloro-N-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(2-bromo-4-pyridinyl)-2,7-dichloro-N-methylquinazolin-4-amine;8-chloro-N-methyl-N-[2-[2-[1-(trifluoromethyl)cyclopropyl]ethynyl]-4-pyridinyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;diethoxymethoxyethane;1-ethynyl-1-(trifluoromethyl)cyclopropane;2,4,7-trichloroquinazoline
CID 167663557
N-aminohydroxylamine;1-bromo-3-(3,3-difluoropropyl)-5-fluorobenzene;N-(3-bromo-5-fluorophenyl)-7-chloro-N-(2,2-difluoroethyl)-5-fluoro-2-hydrazinylquinazolin-4-amine;N-(3-bromo-5-fluorophenyl)-8-chloro-N-(2,2-difluoroethyl)-6-fluoro-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromo-5-fluorophenyl)-2,7-dichloro-N-(2,2-difluoroethyl)-5-fluoroquinazolin-4-amine;8-chloro-N-(2,2-difluoroethyl)-6-fluoro-N-[3-fluoro-5-[2-[1-(trifluoromethyl)cyclopropyl]ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;1-ethynyl-1-(trifluoromethyl)cyclopropane;2,4,7-trichloro-5-fluoroquinazoline;1,1,1-triethoxyethane
CID 167710443

Frequently Asked Questions

What is the IUPAC name of 3-bromoaniline;1-bromo-3-(2-cyclopropylethyl)benzene;(3E)-N-(3-bromophenyl)-6-chloro-N-(cyclopropylmethyl)-3-hydrazinylidene-4H-isoquinolin-1-amine;N-(3-bromophenyl)-8-chloro-N-(cyclopropylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromophenyl)-2,7-dichloro-N-(cyclopropylmethyl)quinazolin-4-amine;8-chloro-N-(cyclopropylmethyl)-N-[3-[2-(1-methylcyclopropyl)ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;cyclopropanecarbaldehyde;diethoxymethoxyethane;1-ethynyl-1-methylcyclopropane;hydrazine;methane;2,4,7-trichloroquinazoline?
The IUPAC name of 3-bromoaniline;1-bromo-3-(2-cyclopropylethyl)benzene;(3E)-N-(3-bromophenyl)-6-chloro-N-(cyclopropylmethyl)-3-hydrazinylidene-4H-isoquinolin-1-amine;N-(3-bromophenyl)-8-chloro-N-(cyclopropylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromophenyl)-2,7-dichloro-N-(cyclopropylmethyl)quinazolin-4-amine;8-chloro-N-(cyclopropylmethyl)-N-[3-[2-(1-methylcyclopropyl)ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;cyclopropanecarbaldehyde;diethoxymethoxyethane;1-ethynyl-1-methylcyclopropane;hydrazine;methane;2,4,7-trichloroquinazoline (CID 172942356) is 3-bromoaniline;1-bromo-3-(2-cyclopropylethyl)benzene;(3E)-N-(3-bromophenyl)-6-chloro-N-(cyclopropylmethyl)-3-hydrazinylidene-4H-isoquinolin-1-amine;N-(3-bromophenyl)-8-chloro-N-(cyclopropylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromophenyl)-2,7-dichloro-N-(cyclopropylmethyl)quinazolin-4-amine;8-chloro-N-(cyclopropylmethyl)-N-[3-[2-(1-methylcyclopropyl)ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;cyclopropanecarbaldehyde;diethoxymethoxyethane;1-ethynyl-1-methylcyclopropane;hydrazine;methane;2,4,7-trichloroquinazoline.
What is the SMILES notation for 3-bromoaniline;1-bromo-3-(2-cyclopropylethyl)benzene;(3E)-N-(3-bromophenyl)-6-chloro-N-(cyclopropylmethyl)-3-hydrazinylidene-4H-isoquinolin-1-amine;N-(3-bromophenyl)-8-chloro-N-(cyclopropylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromophenyl)-2,7-dichloro-N-(cyclopropylmethyl)quinazolin-4-amine;8-chloro-N-(cyclopropylmethyl)-N-[3-[2-(1-methylcyclopropyl)ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;cyclopropanecarbaldehyde;diethoxymethoxyethane;1-ethynyl-1-methylcyclopropane;hydrazine;methane;2,4,7-trichloroquinazoline?
The canonical SMILES for 3-bromoaniline;1-bromo-3-(2-cyclopropylethyl)benzene;(3E)-N-(3-bromophenyl)-6-chloro-N-(cyclopropylmethyl)-3-hydrazinylidene-4H-isoquinolin-1-amine;N-(3-bromophenyl)-8-chloro-N-(cyclopropylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromophenyl)-2,7-dichloro-N-(cyclopropylmethyl)quinazolin-4-amine;8-chloro-N-(cyclopropylmethyl)-N-[3-[2-(1-methylcyclopropyl)ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;cyclopropanecarbaldehyde;diethoxymethoxyethane;1-ethynyl-1-methylcyclopropane;hydrazine;methane;2,4,7-trichloroquinazoline is Brc1cccc(CCC2CC2)c1.C.C#CC1(C)CC1.CC1(C#Cc2cccc(N(CC3CC3)c3nc4nncn4c4cc(Cl)ccc34)c2)CC1.CCOC(OCC)OCC.Clc1ccc2c(Cl)nc(Cl)nc2c1.Clc1ccc2c(N(CC3CC3)c3cccc(Br)c3)nc(Cl)nc2c1.Clc1ccc2c(N(CC3CC3)c3cccc(Br)c3)nc3nncn3c2c1.N/N=C1\Cc2cc(Cl)ccc2C(N(CC2CC2)c2cccc(Br)c2)=N1.NN.Nc1cccc(Br)c1.O=CC1CC1.
What is the InChIKey of 3-bromoaniline;1-bromo-3-(2-cyclopropylethyl)benzene;(3E)-N-(3-bromophenyl)-6-chloro-N-(cyclopropylmethyl)-3-hydrazinylidene-4H-isoquinolin-1-amine;N-(3-bromophenyl)-8-chloro-N-(cyclopropylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromophenyl)-2,7-dichloro-N-(cyclopropylmethyl)quinazolin-4-amine;8-chloro-N-(cyclopropylmethyl)-N-[3-[2-(1-methylcyclopropyl)ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;cyclopropanecarbaldehyde;diethoxymethoxyethane;1-ethynyl-1-methylcyclopropane;hydrazine;methane;2,4,7-trichloroquinazoline?
The InChIKey is VYYIVHFXJVHKCS-WXWJAHRZSA-N. The full InChI is InChI=1S/C25H22ClN5.C19H15BrClN5.C19H18BrClN4.C18H14BrCl2N3.C11H13Br.C8H3Cl3N2.C7H16O3.C6H6BrN.C6H8.C4H6O.CH4.H4N2/c1-25(11-12-25)10-9-17-3-2-4-20(13-17)30(15-18-5-6-18)23-21-8-7-19(26)14-22(21)31-16-27-29-24(31)28-23;20-13-2-1-3-15(8-13)25(10-12-4-5-12)18-16-7-6-14(21)9-17(16)26-11-22-24-19(26)23-18;20-14-2-1-3-16(10-14)25(11-12-4-5-12)19-17-7-6-15(21)8-13(17)9-18(23-19)24-22;19-12-2-1-3-14(8-12)24(10-11-4-5-11)17-15-7-6-13(20)9-16(15)22-18(21)23-17;12-11-3-1-2-10(8-11)7-6-9-4-5-9;9-4-1-2-5-6(3-4)12-8(11)13-7(5)10;1-4-8-7(9-5-2)10-6-3;7-5-2-1-3-6(8)4-5;1-3-6(2)4-5-6;5-3-4-1-2-4;;1-2/h2-4,7-8,13-14,16,18H,5-6,11-12,15H2,1H3;1-3,6-9,11-12H,4-5,10H2;1-3,6-8,10,12H,4-5,9,11,22H2;1-3,6-9,11H,4-5,10H2;1-3,8-9H,4-7H2;1-3H;7H,4-6H2,1-3H3;1-4H,8H2;1H,4-5H2,2H3;3-4H,1-2H2;1H4;1-2H2/b;;24-18+;;;;;;;;;.
What are the key properties of 3-bromoaniline;1-bromo-3-(2-cyclopropylethyl)benzene;(3E)-N-(3-bromophenyl)-6-chloro-N-(cyclopropylmethyl)-3-hydrazinylidene-4H-isoquinolin-1-amine;N-(3-bromophenyl)-8-chloro-N-(cyclopropylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromophenyl)-2,7-dichloro-N-(cyclopropylmethyl)quinazolin-4-amine;8-chloro-N-(cyclopropylmethyl)-N-[3-[2-(1-methylcyclopropyl)ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;cyclopropanecarbaldehyde;diethoxymethoxyethane;1-ethynyl-1-methylcyclopropane;hydrazine;methane;2,4,7-trichloroquinazoline?
3-bromoaniline;1-bromo-3-(2-cyclopropylethyl)benzene;(3E)-N-(3-bromophenyl)-6-chloro-N-(cyclopropylmethyl)-3-hydrazinylidene-4H-isoquinolin-1-amine;N-(3-bromophenyl)-8-chloro-N-(cyclopropylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromophenyl)-2,7-dichloro-N-(cyclopropylmethyl)quinazolin-4-amine;8-chloro-N-(cyclopropylmethyl)-N-[3-[2-(1-methylcyclopropyl)ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;cyclopropanecarbaldehyde;diethoxymethoxyethane;1-ethynyl-1-methylcyclopropane;hydrazine;methane;2,4,7-trichloroquinazoline has a molecular weight of 2674.69 g/mol, XLogP of 33.98, 25 rotatable bonds, 4 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromoaniline;1-bromo-3-(2-cyclopropylethyl)benzene;(3E)-N-(3-bromophenyl)-6-chloro-N-(cyclopropylmethyl)-3-hydrazinylidene-4H-isoquinolin-1-amine;N-(3-bromophenyl)-8-chloro-N-(cyclopropylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;N-(3-bromophenyl)-2,7-dichloro-N-(cyclopropylmethyl)quinazolin-4-amine;8-chloro-N-(cyclopropylmethyl)-N-[3-[2-(1-methylcyclopropyl)ethynyl]phenyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine;cyclopropanecarbaldehyde;diethoxymethoxyethane;1-ethynyl-1-methylcyclopropane;hydrazine;methane;2,4,7-trichloroquinazoline is sourced from PubChem (CID 172942356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).