6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,4,7-trichloroquinazoline;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;urea

C99H114B2Br6Cl14N23O19P — CID 158276417

IUPAC6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,4,7-trichloroquinazoline;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;urea
SMILESCC(C)(C)OC(=O)N1CCN(c2nc(Cl)nc3cc(Cl)c(Br)cc23)CC1.CC(C)(C)OC(=O)N1CCN(c2nc(N)nc3cc(Cl)c(Br)cc23)CC1.CC(C)(C)OC(=O)N1CCNCC1.CN.COC(=O)c1cc(Br)c(Cl)cc1N.COc1nc(N2CCN(C(=O)OC(C)(C)C)CC2)c2cc(Br)c(Cl)cc2n1.Clc1nc(Cl)c2cc(Br)c(Cl)cc2n1.NC(N)=O.O=P(Cl)(Cl)Cl.O=c1[nH]c(=O)c2cc(Br)c(Cl)cc2[nH]1.OB(O)c1ccc(Cl)cc1.OB(O)c1ccc(Cl)cc1
InChIInChI=1S/C18H22BrClN4O3.C17H19BrCl2N4O2.C17H21BrClN5O2.C9H18N2O2.C8H2BrCl3N2.C8H4BrClN2O2.C8H7BrClNO2.2C6H6BClO2.CH4N2O.CH5N.Cl3OP/c1-18(2,3)27-17(25)24-7-5-23(6-8-24)15-11-9-12(19)13(20)10-14(11)21-16(22-15)26-4;2*1-17(2,3)26-16(25)24-6-4-23(5-7-24)14-10-8-11(18)12(19)9-13(10)21-15(20)22-14;1-9(2,3)13-8(12)11-6-4-10-5-7-11;9-4-1-3-6(2-5(4)10)13-8(12)14-7(3)11;9-4-1-3-6(2-5(4)10)11-8(14)12-7(3)13;1-13-8(12)4-2-5(9)6(10)3-7(4)11;2*8-6-3-1-5(2-4-6)7(9)10;2-1(3)4;1-2;1-5(2,3)4/h9-10H,5-8H2,1-4H3;8-9H,4-7H2,1-3H3;8-9H,4-7H2,1-3H3,(H2,20,21,22);10H,4-7H2,1-3H3;1-2H;1-2H,(H2,11,12,13,14);2-3H,11H2,1H3;2*1-4,9-10H;(H4,2,3,4);2H2,1H3;
InChIKeyGJQVMKUKAKKPGM-UHFFFAOYSA-N
MW2958.51 g/mol
LogP23.28
Rot. Bonds7

About 6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,4,7-trichloroquinazoline;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;urea

6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,4,7-trichloroquinazoline;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;urea (PubChem CID 158276417) has the molecular formula C99H114B2Br6Cl14N23O19P and a molecular weight of 2958.51 g/mol. Its IUPAC name is 6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,4,7-trichloroquinazoline;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;urea.

Molecular Properties

Compound Name6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,4,7-trichloroquinazoline;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;urea
PubChem CID158276417
Molecular FormulaC99H114B2Br6Cl14N23O19P
Molecular Weight2958.51 g/mol
Exact Mass2944.93
IUPAC Name6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,4,7-trichloroquinazoline;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;urea
SMILESCC(C)(C)OC(=O)N1CCN(c2nc(Cl)nc3cc(Cl)c(Br)cc23)CC1.CC(C)(C)OC(=O)N1CCN(c2nc(N)nc3cc(Cl)c(Br)cc23)CC1.CC(C)(C)OC(=O)N1CCNCC1.CN.COC(=O)c1cc(Br)c(Cl)cc1N.COc1nc(N2CCN(C(=O)OC(C)(C)C)CC2)c2cc(Br)c(Cl)cc2n1.Clc1nc(Cl)c2cc(Br)c(Cl)cc2n1.NC(N)=O.O=P(Cl)(Cl)Cl.O=c1[nH]c(=O)c2cc(Br)c(Cl)cc2[nH]1.OB(O)c1ccc(Cl)cc1.OB(O)c1ccc(Cl)cc1
InChIInChI=1S/C18H22BrClN4O3.C17H19BrCl2N4O2.C17H21BrClN5O2.C9H18N2O2.C8H2BrCl3N2.C8H4BrClN2O2.C8H7BrClNO2.2C6H6BClO2.CH4N2O.CH5N.Cl3OP/c1-18(2,3)27-17(25)24-7-5-23(6-8-24)15-11-9-12(19)13(20)10-14(11)21-16(22-15)26-4;2*1-17(2,3)26-16(25)24-6-4-23(5-7-24)14-10-8-11(18)12(19)9-13(10)21-15(20)22-14;1-9(2,3)13-8(12)11-6-4-10-5-7-11;9-4-1-3-6(2-5(4)10)13-8(12)14-7(3)11;9-4-1-3-6(2-5(4)10)11-8(14)12-7(3)13;1-13-8(12)4-2-5(9)6(10)3-7(4)11;2*8-6-3-1-5(2-4-6)7(9)10;2-1(3)4;1-2;1-5(2,3)4/h9-10H,5-8H2,1-4H3;8-9H,4-7H2,1-3H3;8-9H,4-7H2,1-3H3,(H2,20,21,22);10H,4-7H2,1-3H3;1-2H;1-2H,(H2,11,12,13,14);2-3H,11H2,1H3;2*1-4,9-10H;(H4,2,3,4);2H2,1H3;
InChIKeyGJQVMKUKAKKPGM-UHFFFAOYSA-N
XLogP23.28
TPSA589.44 Ų
H-Bond Donors12
H-Bond Acceptors34
Rotatable Bonds7
Heavy Atoms164
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002958.51
LogP ≤ 523.28
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1034

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze 6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,4,7-trichloroquinazoline;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;urea with MolForge

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Launch Full Analysis

Related Compounds

6-bromo-7-chloro-4-piperidin-1-ylquinazoline;6-bromo-7-chloro-3H-quinazolin-4-one;6-bromo-4,7-dichloroquinazoline;tert-butyl 4-(7-chloro-6-phenylquinazolin-4-yl)piperazine-1-carboxylate;7-chloro-6-phenyl-4-piperidin-1-ylquinazoline;1-[4-(7-chloro-6-phenylquinazolin-4-yl)piperazin-1-yl]prop-2-en-1-one;formamide;methanol;methyl 2-amino-5-bromo-4-chlorobenzoate;phenylboronic acid;piperidine;prop-2-enoyl chloride;dihydrochloride
CID 157305940
tert-butyl 4-[7-chloro-6-(2-chlorophenyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;7-chloro-6-(2-chlorophenyl)-3H-quinazolin-4-one;(2-chlorophenyl)boronic acid;4,7-dichloro-6-(2-chlorophenyl)quinazoline;methanol;methyl 2-amino-5-bromo-4-chlorobenzoate;methyl 2-amino-4-chloro-5-(2-chlorophenyl)benzoate;hydrochloride
CID 157438673
tert-butyl 4-[7-chloro-6-(4-chlorophenyl)quinazolin-4-yl]-2-(hydroxymethyl)piperazine-1-carboxylate;tert-butyl 2-(hydroxymethyl)piperazine-1-carboxylate;7-chloro-6-(4-chlorophenyl)-3H-quinazolin-4-one;1-[4-[7-chloro-6-(4-chlorophenyl)quinazolin-4-yl]-2-(hydroxymethyl)piperazin-1-yl]prop-2-en-1-one;[1-[7-chloro-6-(4-chlorophenyl)quinazolin-4-yl]piperidin-3-yl]methanol;(4-chlorophenyl)boronic acid;4,7-dichloro-6-(4-chlorophenyl)quinazoline;methane;methanol;methyl 2-amino-5-bromo-4-chlorobenzoate;methyl 2-amino-4-chloro-5-(4-chlorophenyl)benzoate;oxoboranylphosphane;prop-2-enoic acid;dihydrochloride
CID 157745773
2-amino-4-bromo-5-chloro-3-fluorobenzoic acid;2-amino-4-bromo-3-fluorobenzoic acid;6-bromo-7-chloro-8-fluoro-1H-quinazoline-2,4-dione;7-bromo-2,4,6-trichloro-8-fluoroquinazoline;tert-butyl (2R,5S)-4-(7-bromo-2,6-dichloro-8-fluoroquinazolin-4-yl)-2,5-dimethylpiperazine-1-carboxylate;tert-butyl (2R,5S)-2,5-dimethylpiperazine-1-carboxylate;deuterio(fluoro)methane;N,N-dimethylazetidin-3-amine;methane;urea
CID 157856274
tert-butyl 4-[7-chloro-6-(4-chlorophenyl)quinazolin-4-yl]-2-(hydroxymethyl)piperazine-1-carboxylate;tert-butyl 2-(hydroxymethyl)piperazine-1-carboxylate;7-chloro-6-(4-chlorophenyl)-3H-quinazolin-4-one;[1-[7-chloro-6-(4-chlorophenyl)quinazolin-4-yl]piperidin-3-yl]methanol;(4-chlorophenyl)boronic acid;4,7-dichloro-6-(4-chlorophenyl)quinazoline;methane;methanol;methyl 2-amino-5-bromo-4-chlorobenzoate;methyl 2-amino-4-chloro-5-(4-chlorophenyl)benzoate;oxoboranylphosphane;prop-2-enoic acid;dihydrochloride
CID 157950507
2-amino-4-bromo-5-chlorobenzoic acid;7-bromo-6-chloro-1H-quinazoline-2,4-dione;7-bromo-2,4,6-trichloroquinazoline;tert-butyl 4-(7-bromo-2,6-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;N,N-dimethylaniline;urea
CID 158466368
acetonitrile;6-bromo-4-(4-bromopiperazin-1-yl)-7-chloro-2-methylquinazoline;6-bromo-7-chloro-2-methyl-3H-quinazolin-4-one;6-bromo-4,7-dichloro-2-methylquinazoline;tert-butyl 4-[7-chloro-6-(4-chlorophenyl)-2-methylquinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;1-[4-[7-chloro-6-(4-chlorophenyl)-2-methylquinazolin-4-yl]piperazin-1-yl]prop-2-en-1-one;(4-chlorophenyl)boronic acid;methyl 2-amino-5-bromo-4-chlorobenzoate;prop-2-enoyl chloride;thionyl dichloride
CID 159954066
tert-butyl 4-[7-chloro-6-(4-chlorophenyl)quinazolin-4-yl]-2-(hydroxymethyl)piperazine-1-carboxylate;tert-butyl 2-(hydroxymethyl)piperazine-1-carboxylate;7-chloro-6-(4-chlorophenyl)-3H-quinazolin-4-one;1-[4-[7-chloro-6-(4-chlorophenyl)quinazolin-4-yl]-2-(hydroxymethyl)piperazin-1-yl]prop-2-en-1-one;[1-[7-chloro-6-(4-chlorophenyl)quinazolin-4-yl]piperidin-3-yl]methanol;(4-chlorophenyl)boronic acid;4,7-dichloro-6-(4-chlorophenyl)quinazoline;methanol;methyl 2-amino-5-bromo-4-chlorobenzoate;methyl 2-amino-4-chloro-5-(4-chlorophenyl)benzoate;oxoboranylphosphane;prop-2-enoic acid;dihydrochloride
CID 160220653
tert-butyl 4-[7-chloro-6-(4-chlorophenyl)quinazolin-4-yl]-2-(hydroxymethyl)piperazine-1-carboxylate;tert-butyl 2-(hydroxymethyl)piperazine-1-carboxylate;7-chloro-6-(4-chlorophenyl)-3H-quinazolin-4-one;(4-chlorophenyl)boronic acid;4,7-dichloro-6-(4-chlorophenyl)quinazoline;methanol;methyl 2-amino-5-bromo-4-chlorobenzoate;methyl 2-amino-4-chloro-5-(4-chlorophenyl)benzoate;hydrochloride
CID 160342084
1-[4-[2-amino-7-chloro-6-(4-chlorophenyl)quinazolin-4-yl]piperazin-1-yl]prop-2-en-1-one;6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,7-dichloro-3H-quinazolin-4-one;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-[2-amino-7-chloro-6-(4-chlorophenyl)quinazolin-4-yl]piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-[7-chloro-6-(4-chlorophenyl)-2-methoxyquinazolin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;1-[4-[7-chloro-6-(4-chlorophenyl)-2-methoxyquinazolin-4-yl]piperazin-1-yl]prop-2-en-1-one;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;prop-2-enoic acid;prop-2-enoyl chloride;urea
CID 160381360
6-bromo-7-chloro-3H-quinazolin-4-one;6-bromo-4,7-dichloroquinazoline;tert-butyl 4-(6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(7-chloro-6-phenylquinazolin-4-yl)piperazine-1-carboxylate;7-chloro-6-phenyl-4-piperidin-1-ylquinazoline;1-[4-(7-chloro-6-phenylquinazolin-4-yl)piperazin-1-yl]prop-2-en-1-one;formamide;methanol;methyl 2-amino-5-bromo-4-chlorobenzoate;phenylboronic acid;piperidine;prop-2-enoyl chloride;dihydrochloride
CID 160496556
2-amino-5-bromobenzamide;6-bromo-1H-3,1-benzoxazine-2,4-dione;6-bromo-2-chloro-N-(2-morpholin-4-ylethyl)quinazolin-4-amine;6-bromo-2,4-dichloroquinazoline;6-bromo-2-(4-methylpiperazin-1-yl)-N-(2-morpholin-4-ylethyl)quinazolin-4-amine;6-bromo-1H-quinazoline-2,4-dione;diiodomethane;methane;2-(4-methylpiperazin-1-yl)-N-(2-morpholin-4-ylethyl)-6-phenylquinazolin-4-amine
CID 160517088

Frequently Asked Questions

What is the IUPAC name of 6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,4,7-trichloroquinazoline;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;urea?
The IUPAC name of 6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,4,7-trichloroquinazoline;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;urea (CID 158276417) is 6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,4,7-trichloroquinazoline;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;urea.
What is the SMILES notation for 6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,4,7-trichloroquinazoline;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;urea?
The canonical SMILES for 6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,4,7-trichloroquinazoline;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;urea is CC(C)(C)OC(=O)N1CCN(c2nc(Cl)nc3cc(Cl)c(Br)cc23)CC1.CC(C)(C)OC(=O)N1CCN(c2nc(N)nc3cc(Cl)c(Br)cc23)CC1.CC(C)(C)OC(=O)N1CCNCC1.CN.COC(=O)c1cc(Br)c(Cl)cc1N.COc1nc(N2CCN(C(=O)OC(C)(C)C)CC2)c2cc(Br)c(Cl)cc2n1.Clc1nc(Cl)c2cc(Br)c(Cl)cc2n1.NC(N)=O.O=P(Cl)(Cl)Cl.O=c1[nH]c(=O)c2cc(Br)c(Cl)cc2[nH]1.OB(O)c1ccc(Cl)cc1.OB(O)c1ccc(Cl)cc1.
What is the InChIKey of 6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,4,7-trichloroquinazoline;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;urea?
The InChIKey is GJQVMKUKAKKPGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22BrClN4O3.C17H19BrCl2N4O2.C17H21BrClN5O2.C9H18N2O2.C8H2BrCl3N2.C8H4BrClN2O2.C8H7BrClNO2.2C6H6BClO2.CH4N2O.CH5N.Cl3OP/c1-18(2,3)27-17(25)24-7-5-23(6-8-24)15-11-9-12(19)13(20)10-14(11)21-16(22-15)26-4;2*1-17(2,3)26-16(25)24-6-4-23(5-7-24)14-10-8-11(18)12(19)9-13(10)21-15(20)22-14;1-9(2,3)13-8(12)11-6-4-10-5-7-11;9-4-1-3-6(2-5(4)10)13-8(12)14-7(3)11;9-4-1-3-6(2-5(4)10)11-8(14)12-7(3)13;1-13-8(12)4-2-5(9)6(10)3-7(4)11;2*8-6-3-1-5(2-4-6)7(9)10;2-1(3)4;1-2;1-5(2,3)4/h9-10H,5-8H2,1-4H3;8-9H,4-7H2,1-3H3;8-9H,4-7H2,1-3H3,(H2,20,21,22);10H,4-7H2,1-3H3;1-2H;1-2H,(H2,11,12,13,14);2-3H,11H2,1H3;2*1-4,9-10H;(H4,2,3,4);2H2,1H3;.
What are the key properties of 6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,4,7-trichloroquinazoline;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;urea?
6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,4,7-trichloroquinazoline;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;urea has a molecular weight of 2958.51 g/mol, XLogP of 23.28, 7 rotatable bonds, 12 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-7-chloro-1H-quinazoline-2,4-dione;6-bromo-2,4,7-trichloroquinazoline;tert-butyl 4-(2-amino-6-bromo-7-chloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-7-chloro-2-methoxyquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl 4-(6-bromo-2,7-dichloroquinazolin-4-yl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis((4-chlorophenyl)boronic acid);methanamine;methyl 2-amino-5-bromo-4-chlorobenzoate;phosphoryl trichloride;urea is sourced from PubChem (CID 158276417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).