AE25841
1046861-17-9 | Ethyl 2-amino-4-chloro-5h-pyrrolo[3,4-d]pyrimidine-6(7h)-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AE25841
ChemicalName
Ethyl 2-amino-4-chloro-5h-pyrrolo[3,4-d]pyrimidine-6(7h)-carboxylate
CasNumber
1046861-17-9
MolecularFormula
C9H11ClN4O2
MolecularWeight
242.6622
MdlNumber
MFCD14706243
Smiles
CCOC(=O)N1Cc2c(C1)c(Cl)nc(=N)[nH]2
Complexity
278
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
0.5
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CatalogNumber: AE25841
ChemicalName: Ethyl 2-amino-4-chloro-5h-pyrrolo[3,4-d]pyrimidine-6(7h)-carboxylate
CasNumber: 1046861-17-9
MolecularFormula: C9H11ClN4O2
MolecularWeight: 242.6622
MdlNumber: MFCD14706243
Smiles: CCOC(=O)N1Cc2c(C1)c(Cl)nc(=N)[nH]2
Complexity: 278
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.5
CatalogNumber:
AE25841
ChemicalName:
Ethyl 2-amino-4-chloro-5h-pyrrolo[3,4-d]pyrimidine-6(7h)-carboxylate
CasNumber:
1046861-17-9
MolecularFormula:
C9H11ClN4O2
MolecularWeight:
242.6622
MdlNumber:
MFCD14706243
Smiles:
CCOC(=O)N1Cc2c(C1)c(Cl)nc(=N)[nH]2
Complexity:
278
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.5
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Smiles: CCc1cn2c(s1)ncc2
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CCc1cn2c(s1)ncc2
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Smiles: Cc1cn2c(n1)C(O)CCC2
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Smiles:
Cc1cn2c(n1)C(O)CCC2
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: OC1(CNCC1)c1cccnc1
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Smiles:
OC1(CNCC1)c1cccnc1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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