AD10475
99513-52-7 | (1,3-Benzothiazol-2-ylmethoxy)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AD10475
ChemicalName
(1,3-Benzothiazol-2-ylmethoxy)acetic acid
CasNumber
99513-52-7
MolecularFormula
C10H9NO3S
MolecularWeight
223.2484
MdlNumber
MFCD00630273
Smiles
OC(=O)COCc1nc2c(s1)cccc2
Complexity
237
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
1.7
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CatalogNumber: AD10475
ChemicalName: (1,3-Benzothiazol-2-ylmethoxy)acetic acid
CasNumber: 99513-52-7
MolecularFormula: C10H9NO3S
MolecularWeight: 223.2484
MdlNumber: MFCD00630273
Smiles: OC(=O)COCc1nc2c(s1)cccc2
Complexity: 237
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 1.7
CatalogNumber:
AD10475
ChemicalName:
(1,3-Benzothiazol-2-ylmethoxy)acetic acid
CasNumber:
99513-52-7
MolecularFormula:
C10H9NO3S
MolecularWeight:
223.2484
MdlNumber:
MFCD00630273
Smiles:
OC(=O)COCc1nc2c(s1)cccc2
Complexity:
237
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
1.7
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MolecularFormula: __
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Smiles: CN(CCc1c[nH]c2c1cc(N)cc2)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CN(CCc1c[nH]c2c1cc(N)cc2)C
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: CCOc1ccc(cc1)[Si](COCc1cccc(c1)Oc1ccccc1)(C)C
Complexity: __
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HeavyAtomCount: __
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MolecularFormula:
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Smiles:
CCOc1ccc(cc1)[Si](COCc1cccc(c1)Oc1ccccc1)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
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Smiles: FC(c1ccn(n1)c1ccccc1)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
FC(c1ccn(n1)c1ccccc1)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__