4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2,6-difluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate

C96H99Cl5F4N28O16S4 — CID 163736541

IUPAC4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2,6-difluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate
SMILESNc1nc(Cl)nc2c1ncn2CCCCOC(=O)NCc1ccc(S(=O)(=O)NCc2c(F)cccc2F)cc1.Nc1nc(Cl)nc2c1ncn2CCCCOC(=O)NCc1ccc(S(=O)(=O)NCc2ccc(Cl)cc2)cc1.Nc1nc(Cl)nc2c1ncn2CCCCOC(=O)NCc1ccc(S(=O)(=O)NCc2cccc(F)c2)cc1.Nc1nc(Cl)nc2c1ncn2CCCCOC(=O)NCc1ccc(S(=O)(=O)NCc2ccccc2F)cc1
InChIInChI=1S/C24H25Cl2N7O4S.C24H24ClF2N7O4S.2C24H25ClFN7O4S/c25-18-7-3-17(4-8-18)14-30-38(35,36)19-9-5-16(6-10-19)13-28-24(34)37-12-2-1-11-33-15-29-20-21(27)31-23(26)32-22(20)33;25-23-32-21(28)20-22(33-23)34(14-30-20)10-1-2-11-38-24(35)29-12-15-6-8-16(9-7-15)39(36,37)31-13-17-18(26)4-3-5-19(17)27;25-23-31-21(27)20-22(32-23)33(15-29-20)10-1-2-11-37-24(34)28-13-16-6-8-19(9-7-16)38(35,36)30-14-17-4-3-5-18(26)12-17;25-23-31-21(27)20-22(32-23)33(15-29-20)11-3-4-12-37-24(34)28-13-16-7-9-18(10-8-16)38(35,36)30-14-17-5-1-2-6-19(17)26/h3-10,15,30H,1-2,11-14H2,(H,28,34)(H2,27,31,32);3-9,14,31H,1-2,10-13H2,(H,29,35)(H2,28,32,33);3-9,12,15,30H,1-2,10-11,13-14H2,(H,28,34)(H2,27,31,32);1-2,5-10,15,30H,3-4,11-14H2,(H,28,34)(H2,27,31,32)
InChIKeyLECBDMZUBXWLHN-UHFFFAOYSA-N
MW2282.55 g/mol
LogP14.20
Rot. Bonds44

About 4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2,6-difluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate

4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2,6-difluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate (PubChem CID 163736541) has the molecular formula C96H99Cl5F4N28O16S4 and a molecular weight of 2282.55 g/mol. Its IUPAC name is 4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2,6-difluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate.

Molecular Properties

Compound Name4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2,6-difluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate
PubChem CID163736541
Molecular FormulaC96H99Cl5F4N28O16S4
Molecular Weight2282.55 g/mol
Exact Mass2278.51
IUPAC Name4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2,6-difluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate
SMILESNc1nc(Cl)nc2c1ncn2CCCCOC(=O)NCc1ccc(S(=O)(=O)NCc2c(F)cccc2F)cc1.Nc1nc(Cl)nc2c1ncn2CCCCOC(=O)NCc1ccc(S(=O)(=O)NCc2ccc(Cl)cc2)cc1.Nc1nc(Cl)nc2c1ncn2CCCCOC(=O)NCc1ccc(S(=O)(=O)NCc2cccc(F)c2)cc1.Nc1nc(Cl)nc2c1ncn2CCCCOC(=O)NCc1ccc(S(=O)(=O)NCc2ccccc2F)cc1
InChIInChI=1S/C24H25Cl2N7O4S.C24H24ClF2N7O4S.2C24H25ClFN7O4S/c25-18-7-3-17(4-8-18)14-30-38(35,36)19-9-5-16(6-10-19)13-28-24(34)37-12-2-1-11-33-15-29-20-21(27)31-23(26)32-22(20)33;25-23-32-21(28)20-22(33-23)34(14-30-20)10-1-2-11-38-24(35)29-12-15-6-8-16(9-7-15)39(36,37)31-13-17-18(26)4-3-5-19(17)27;25-23-31-21(27)20-22(32-23)33(15-29-20)10-1-2-11-37-24(34)28-13-16-6-8-19(9-7-16)38(35,36)30-14-17-4-3-5-18(26)12-17;25-23-31-21(27)20-22(32-23)33(15-29-20)11-3-4-12-37-24(34)28-13-16-7-9-18(10-8-16)38(35,36)30-14-17-5-1-2-6-19(17)26/h3-10,15,30H,1-2,11-14H2,(H,28,34)(H2,27,31,32);3-9,14,31H,1-2,10-13H2,(H,29,35)(H2,28,32,33);3-9,12,15,30H,1-2,10-11,13-14H2,(H,28,34)(H2,27,31,32);1-2,5-10,15,30H,3-4,11-14H2,(H,28,34)(H2,27,31,32)
InChIKeyLECBDMZUBXWLHN-UHFFFAOYSA-N
XLogP14.20
TPSA616.48 Ų
H-Bond Donors12
H-Bond Acceptors36
Rotatable Bonds44
Heavy Atoms153
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002282.55
LogP ≤ 514.20
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1036

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2,6-difluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate with MolForge

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Related Compounds

4-(6-amino-2-fluoropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate
CID 132109034
4-(6-amino-2-fluoropurin-9-yl)butyl N-[[4-[[4-(trifluoromethyl)phenyl]methylsulfamoyl]phenyl]methyl]carbamate;4-[6-amino-2-(3-methylbutyl)purin-9-yl]butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-[6-amino-2-(3-methylbut-1-ynyl)purin-9-yl]butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-[6-amino-2-[(Z)-prop-1-enyl]purin-9-yl]butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-propylpurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate
CID 157659122
4-[6-amino-2-(azetidin-1-yl)purin-9-yl]butyl N-[[3-(trifluoromethyl)phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[3-(2-methylprop-1-enyl)phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[3-(2-methylpropyl)phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[(3-propylphenyl)methyl]carbamate;4-[6-amino-2-(dimethylamino)purin-9-yl]butyl N-[[2-chloro-5-(2-methylpropyl)phenyl]methyl]carbamate;4-(6-amino-2-fluoropurin-9-yl)butyl N-[[2-chloro-5-(2-methylpropyl)phenyl]methyl]carbamate
CID 157684364
4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[2-(4-fluorophenyl)ethylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[[4-(trifluoromethyl)phenyl]methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-ethoxypurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-fluoropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-methoxypurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate
CID 159104354
4-(6-amino-2-chloropurin-9-yl)butyl N-[[3,5-bis(trifluoromethyl)phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[2-chloro-3-(trifluoromethyl)phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[2-chloro-5-(trifluoromethyl)phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[(3,6-dichloro-2-fluorophenyl)methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-(trifluoromethyl)phenyl]methyl]carbamate;4-[6-amino-2-(dimethylamino)purin-9-yl]butyl N-[(3,6-dichloro-2-fluorophenyl)methyl]carbamate;4-(6-amino-2-fluoropurin-9-yl)butyl N-[(3,6-dichloro-2-fluorophenyl)methyl]carbamate;4-[6-amino-2-(methylamino)purin-9-yl]butyl N-[(3,6-dichloro-2-fluorophenyl)methyl]carbamate
CID 159507210
4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate
CID 132108708
4-(6-aminopurin-9-yl)butyl N-benzylcarbamate;4-(6-aminopurin-9-yl)butyl N-[(1R)-1-(3-chlorophenyl)ethyl]carbamate;4-(6-aminopurin-9-yl)butyl N-[(1R)-1-(4-chlorophenyl)ethyl]carbamate;4-(6-aminopurin-9-yl)butyl N-[(2-chlorophenyl)methyl]carbamate;4-(6-aminopurin-9-yl)butyl N-[(2,6-dichlorophenyl)methyl]carbamate;4-(6-aminopurin-9-yl)butyl N-[(2,6-difluorophenyl)methyl]carbamate;4-(6-aminopurin-9-yl)butyl N-[(2-fluorophenyl)methyl]carbamate;4-(2,6-diaminopurin-9-yl)butyl N-[(1R)-1-(4-chlorophenyl)ethyl]carbamate
CID 157694218
4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-(benzenesulfonamido)phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[3-(benzylsulfamoyl)phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[[(1S)-1-(4-chlorophenyl)ethyl]sulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[[(1R)-1-(4-chlorophenyl)ethyl]sulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-[6-amino-2-(dimethylamino)purin-9-yl]butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate
CID 158554549
4-[6-amino-2-(cyclopentylmethoxy)purin-9-yl]butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-[6-amino-2-(2-methylpropoxy)purin-9-yl]butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-methylsulfanylpurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-propan-2-yloxypurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-propoxypurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate
CID 159855476
4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-bromophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-cyanophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-ethylpurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-ethynylpurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-methylpurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate
CID 160280445
4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-(methylsulfamoyl)phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-(2-morpholin-4-ylethylsulfamoyl)phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[(4-morpholin-4-ylsulfonylphenyl)methyl]carbamate;4-[6-amino-2-(dimethylamino)purin-9-yl]butyl N-[[4-(dimethylsulfamoyl)phenyl]methyl]carbamate;4-[6-amino-2-(dimethylamino)purin-9-yl]butyl N-[[4-(methylsulfamoyl)phenyl]methyl]carbamate;4-[6-amino-2-(dimethylamino)purin-9-yl]butyl N-[(4-methylsulfonylphenyl)methyl]carbamate
CID 161086103
4-(2-chloro-6-methylpurin-9-yl)butyl N-[[4-(benzenesulfonamido)phenyl]methyl]carbamate;4-(2-chloro-6-methylpurin-9-yl)butyl N-[[4-(methanesulfonamido)phenyl]methyl]carbamate;4-(2-chloro-6-methylpurin-9-yl)butyl N-[[4-(2-methylpropylsulfonylamino)phenyl]methyl]carbamate;4-(2-chloro-6-methylpurin-9-yl)butyl N-(2-pyridin-4-ylethyl)carbamate
CID 163432747

Frequently Asked Questions

What is the IUPAC name of 4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2,6-difluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate?
The IUPAC name of 4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2,6-difluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate (CID 163736541) is 4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2,6-difluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate.
What is the SMILES notation for 4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2,6-difluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate?
The canonical SMILES for 4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2,6-difluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate is Nc1nc(Cl)nc2c1ncn2CCCCOC(=O)NCc1ccc(S(=O)(=O)NCc2c(F)cccc2F)cc1.Nc1nc(Cl)nc2c1ncn2CCCCOC(=O)NCc1ccc(S(=O)(=O)NCc2ccc(Cl)cc2)cc1.Nc1nc(Cl)nc2c1ncn2CCCCOC(=O)NCc1ccc(S(=O)(=O)NCc2cccc(F)c2)cc1.Nc1nc(Cl)nc2c1ncn2CCCCOC(=O)NCc1ccc(S(=O)(=O)NCc2ccccc2F)cc1.
What is the InChIKey of 4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2,6-difluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate?
The InChIKey is LECBDMZUBXWLHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25Cl2N7O4S.C24H24ClF2N7O4S.2C24H25ClFN7O4S/c25-18-7-3-17(4-8-18)14-30-38(35,36)19-9-5-16(6-10-19)13-28-24(34)37-12-2-1-11-33-15-29-20-21(27)31-23(26)32-22(20)33;25-23-32-21(28)20-22(33-23)34(14-30-20)10-1-2-11-38-24(35)29-12-15-6-8-16(9-7-15)39(36,37)31-13-17-18(26)4-3-5-19(17)27;25-23-31-21(27)20-22(32-23)33(15-29-20)10-1-2-11-37-24(34)28-13-16-6-8-19(9-7-16)38(35,36)30-14-17-4-3-5-18(26)12-17;25-23-31-21(27)20-22(32-23)33(15-29-20)11-3-4-12-37-24(34)28-13-16-7-9-18(10-8-16)38(35,36)30-14-17-5-1-2-6-19(17)26/h3-10,15,30H,1-2,11-14H2,(H,28,34)(H2,27,31,32);3-9,14,31H,1-2,10-13H2,(H,29,35)(H2,28,32,33);3-9,12,15,30H,1-2,10-11,13-14H2,(H,28,34)(H2,27,31,32);1-2,5-10,15,30H,3-4,11-14H2,(H,28,34)(H2,27,31,32).
What are the key properties of 4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2,6-difluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate?
4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2,6-difluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate has a molecular weight of 2282.55 g/mol, XLogP of 14.20, 44 rotatable bonds, 12 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(4-chlorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2,6-difluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(2-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate;4-(6-amino-2-chloropurin-9-yl)butyl N-[[4-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]carbamate is sourced from PubChem (CID 163736541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).