AB50326
252917-06-9 | Chir-99021
Manufacturer: A2B Chem
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CatalogNumber
AB50326
ChemicalName
Chir-99021
CasNumber
252917-06-9
MolecularFormula
C22H18Cl2N8
MolecularWeight
465.3379
MdlNumber
MFCD11846251
Smiles
N#Cc1ccc(nc1)NCCNc1ncc(c(n1)c1ccc(cc1Cl)Cl)c1[nH]cc(n1)C
Complexity
645
Covalently-bondedUnitCount
1
HeavyAtomCount
32
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
3
RotatableBondCount
7
Xlogp3
4.3
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CatalogNumber: AB50326
ChemicalName: Chir-99021
CasNumber: 252917-06-9
MolecularFormula: C22H18Cl2N8
MolecularWeight: 465.3379
MdlNumber: MFCD11846251
Smiles: N#Cc1ccc(nc1)NCCNc1ncc(c(n1)c1ccc(cc1Cl)Cl)c1[nH]cc(n1)C
Complexity: 645
Covalently-bondedUnitCount: 1
HeavyAtomCount: 32
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 3
RotatableBondCount: 7
Xlogp3: 4.3
CatalogNumber:
AB50326
ChemicalName:
Chir-99021
CasNumber:
252917-06-9
MolecularFormula:
C22H18Cl2N8
MolecularWeight:
465.3379
MdlNumber:
MFCD11846251
Smiles:
N#Cc1ccc(nc1)NCCNc1ncc(c(n1)c1ccc(cc1Cl)Cl)c1[nH]cc(n1)C
Complexity:
645
Covalently-bondedUnitCount:
1
HeavyAtomCount:
32
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
3
RotatableBondCount:
7
Xlogp3:
4.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCOP(=O)(Oc1ccccc1)OCCCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCOP(=O)(Oc1ccccc1)OCCCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB50328
ChemicalName: 4-Bromo-isothiazole
CasNumber: 24340-77-0
MolecularFormula: C3H2BrNS
MolecularWeight: 164.0237
MdlNumber: MFCD06657593
Smiles: Brc1csnc1
Complexity: 50.1
Covalently-bondedUnitCount: 1
HeavyAtomCount: 6
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.7
CatalogNumber:
AB50328
ChemicalName:
4-Bromo-isothiazole
CasNumber:
24340-77-0
MolecularFormula:
C3H2BrNS
MolecularWeight:
164.0237
MdlNumber:
MFCD06657593
Smiles:
Brc1csnc1
Complexity:
50.1
Covalently-bondedUnitCount:
1
HeavyAtomCount:
6
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.7
CatalogNumber: AB50329
ChemicalName: Flavopiridol Hydrochloride
CasNumber: 131740-09-5
MolecularFormula: C21H21Cl2NO5
MolecularWeight: 438.3011
MdlNumber: MFCD26792554
Smiles: CN1CC[C@@H]([C@@H](C1)O)c1c(O)cc(c2c1oc(cc2=O)c1ccccc1Cl)O.Cl
Complexity: 628
Covalently-bondedUnitCount: 2
HeavyAtomCount: 29
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 4
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AB50329
ChemicalName:
Flavopiridol Hydrochloride
CasNumber:
131740-09-5
MolecularFormula:
C21H21Cl2NO5
MolecularWeight:
438.3011
MdlNumber:
MFCD26792554
Smiles:
CN1CC[C@@H]([C@@H](C1)O)c1c(O)cc(c2c1oc(cc2=O)c1ccccc1Cl)O.Cl
Complexity:
628
Covalently-bondedUnitCount:
2
HeavyAtomCount:
29
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
4
RotatableBondCount:
2
Xlogp3:
__