AG65707
63617-18-5 | 5-(4-Methoxybenzyl)-1,3,4-thiadiazol-2-amine
Manufacturer: A2B Chem
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CatalogNumber
AG65707
ChemicalName
5-(4-Methoxybenzyl)-1,3,4-thiadiazol-2-amine
CasNumber
63617-18-5
MolecularFormula
C10H11N3OS
MolecularWeight
221.2788
MdlNumber
MFCD01044257
Smiles
COc1ccc(cc1)Cc1nnc(s1)N
Complexity
197
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.9
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CatalogNumber: AG65707
ChemicalName: 5-(4-Methoxybenzyl)-1,3,4-thiadiazol-2-amine
CasNumber: 63617-18-5
MolecularFormula: C10H11N3OS
MolecularWeight: 221.2788
MdlNumber: MFCD01044257
Smiles: COc1ccc(cc1)Cc1nnc(s1)N
Complexity: 197
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.9
CatalogNumber:
AG65707
ChemicalName:
5-(4-Methoxybenzyl)-1,3,4-thiadiazol-2-amine
CasNumber:
63617-18-5
MolecularFormula:
C10H11N3OS
MolecularWeight:
221.2788
MdlNumber:
MFCD01044257
Smiles:
COc1ccc(cc1)Cc1nnc(s1)N
Complexity:
197
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1ccc(cc1)OCc1c(C)noc1C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1ccc(cc1)OCc1c(C)noc1C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cc2c(s1)ccc(c2)[N+](=O)[O-]
Complexity: 290
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cc2c(s1)ccc(c2)[N+](=O)[O-]
Complexity:
290
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.6
CatalogNumber: AG65710
ChemicalName: 5-(3-Fluorophenyl)-1,3,4-thiadiazol-2-amine
CasNumber: 59565-52-5
MolecularFormula: C8H6FN3S
MolecularWeight: 195.2167
MdlNumber: MFCD02641788
Smiles: Fc1cccc(c1)c1nnc(s1)N
Complexity: 181
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AG65710
ChemicalName:
5-(3-Fluorophenyl)-1,3,4-thiadiazol-2-amine
CasNumber:
59565-52-5
MolecularFormula:
C8H6FN3S
MolecularWeight:
195.2167
MdlNumber:
MFCD02641788
Smiles:
Fc1cccc(c1)c1nnc(s1)N
Complexity:
181
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.8