AE11284
1038915-73-9 | Mk-4827 (tosylate)
Manufacturer: A2B Chem
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CatalogNumber
AE11284
ChemicalName
Mk-4827 (tosylate)
CasNumber
1038915-73-9
MolecularFormula
C26H28N4O4S
MolecularWeight
492.5899
MdlNumber
MFCD28167748
Smiles
NC(=O)c1cccc2c1nn(c2)c1ccc(cc1)[C@@H]1CCCNC1.Cc1ccc(cc1)S(=O)(=O)O
Complexity
655
Covalently-bondedUnitCount
2
DefinedAtomStereocenterCount
1
HeavyAtomCount
35
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
3
RotatableBondCount
4
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CatalogNumber: AE11284
ChemicalName: Mk-4827 (tosylate)
CasNumber: 1038915-73-9
MolecularFormula: C26H28N4O4S
MolecularWeight: 492.5899
MdlNumber: MFCD28167748
Smiles: NC(=O)c1cccc2c1nn(c2)c1ccc(cc1)[C@@H]1CCCNC1.Cc1ccc(cc1)S(=O)(=O)O
Complexity: 655
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 35
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 3
RotatableBondCount: 4
CatalogNumber:
AE11284
ChemicalName:
Mk-4827 (tosylate)
CasNumber:
1038915-73-9
MolecularFormula:
C26H28N4O4S
MolecularWeight:
492.5899
MdlNumber:
MFCD28167748
Smiles:
NC(=O)c1cccc2c1nn(c2)c1ccc(cc1)[C@@H]1CCCNC1.Cc1ccc(cc1)S(=O)(=O)O
Complexity:
655
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
35
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
3
RotatableBondCount:
4
CatalogNumber: AE11285
ChemicalName: MK-5108
CasNumber: 1010085-13-8
MolecularFormula: C22H21ClFN3O3S
MolecularWeight: 461.9368
MdlNumber: MFCD22124479
Smiles: OC(=O)C1(CCC(CC1)Oc1cccc(c1F)Cl)Cc1cccc(n1)Nc1nccs1
Complexity: 611
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 31
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: 2
RotatableBondCount: 7
CatalogNumber:
AE11285
ChemicalName:
MK-5108
CasNumber:
1010085-13-8
MolecularFormula:
C22H21ClFN3O3S
MolecularWeight:
461.9368
MdlNumber:
MFCD22124479
Smiles:
OC(=O)C1(CCC(CC1)Oc1cccc(c1F)Cl)Cc1cccc(n1)Nc1nccs1
Complexity:
611
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
31
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
2
RotatableBondCount:
7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C=CC1CC1(NC(=O)C1CC2CN1C(=O)C(NC(=O)OC1CC1CCCCCc1c(O2)nc2cc(OC)ccc2n1)C(C)(C)C)C(=O)[N-]S(=O)(=O)C1CC1.[K+]
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C=CC1CC1(NC(=O)C1CC2CN1C(=O)C(NC(=O)OC1CC1CCCCCc1c(O2)nc2cc(OC)ccc2n1)C(C)(C)C)C(=O)[N-]S(=O)(=O)C1CC1.[K+]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ccc(c(c1)C(=O)N1C[C@@H](CC[C@H]1C)COc1ccc(cn1)F)c1ncccn1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ccc(c(c1)C(=O)N1C[C@@H](CC[C@H]1C)COc1ccc(cn1)F)c1ncccn1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__