AV18450
871727-59-2 | (R)-tert-Butyl 2-(2-(methylamino)thiazol-4-yl)pyrrolidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AV18450
ChemicalName
(R)-tert-Butyl 2-(2-(methylamino)thiazol-4-yl)pyrrolidine-1-carboxylate
CasNumber
871727-59-2
MolecularFormula
C13H21N3O2S
MolecularWeight
283.3897
MdlNumber
MFCD30185883
Smiles
CN=c1scc([nH]1)[C@H]1CCCN1C(=O)OC(C)(C)C
Complexity
332
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
2.5
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CatalogNumber: AV18450
ChemicalName: (R)-tert-Butyl 2-(2-(methylamino)thiazol-4-yl)pyrrolidine-1-carboxylate
CasNumber: 871727-59-2
MolecularFormula: C13H21N3O2S
MolecularWeight: 283.3897
MdlNumber: MFCD30185883
Smiles: CN=c1scc([nH]1)[C@H]1CCCN1C(=O)OC(C)(C)C
Complexity: 332
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 2.5
CatalogNumber:
AV18450
ChemicalName:
(R)-tert-Butyl 2-(2-(methylamino)thiazol-4-yl)pyrrolidine-1-carboxylate
CasNumber:
871727-59-2
MolecularFormula:
C13H21N3O2S
MolecularWeight:
283.3897
MdlNumber:
MFCD30185883
Smiles:
CN=c1scc([nH]1)[C@H]1CCCN1C(=O)OC(C)(C)C
Complexity:
332
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
2.5
CatalogNumber: AV18451
ChemicalName: 6-(Methylamino)imidazo[1,2-b]pyridazine-3-carboxylic acid
CasNumber: 1779764-91-8
MolecularFormula: C8H8N4O2
MolecularWeight: 192.1747
MdlNumber: MFCD29917036
Smiles: CN=c1ccc2n([nH]1)c(cn2)C(=O)O
Complexity: 235
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 0.5
CatalogNumber:
AV18451
ChemicalName:
6-(Methylamino)imidazo[1,2-b]pyridazine-3-carboxylic acid
CasNumber:
1779764-91-8
MolecularFormula:
C8H8N4O2
MolecularWeight:
192.1747
MdlNumber:
MFCD29917036
Smiles:
CN=c1ccc2n([nH]1)c(cn2)C(=O)O
Complexity:
235
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
0.5
CatalogNumber: AV18452
ChemicalName: Ethyl 1-allyl-2-benzylidenehydrazinecarboxylate
CasNumber: 111508-26-0
MolecularFormula: C13H16N2O2
MolecularWeight: 232.2783
MdlNumber: MFCD28991896
Smiles: CCOC(=O)N(CC=C)/N=C/c1ccccc1
Complexity: 271
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 6
Xlogp3: 2.8
CatalogNumber:
AV18452
ChemicalName:
Ethyl 1-allyl-2-benzylidenehydrazinecarboxylate
CasNumber:
111508-26-0
MolecularFormula:
C13H16N2O2
MolecularWeight:
232.2783
MdlNumber:
MFCD28991896
Smiles:
CCOC(=O)N(CC=C)/N=C/c1ccccc1
Complexity:
271
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
6
Xlogp3:
2.8
CatalogNumber: AV18453
ChemicalName: (S)-tert-Butyl 3-oxo-5-(trifluoromethyl)-2,9-diazaspiro[5.5]undecane-9-carboxylate
CasNumber: 1341192-02-6
MolecularFormula: C15H23F3N2O3
MolecularWeight: 336.3499
MdlNumber: MFCD22209660
Smiles: O=C1NCC2([C@H](C1)C(F)(F)F)CCN(CC2)C(=O)OC(C)(C)C
Complexity: 477
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AV18453
ChemicalName:
(S)-tert-Butyl 3-oxo-5-(trifluoromethyl)-2,9-diazaspiro[5.5]undecane-9-carboxylate
CasNumber:
1341192-02-6
MolecularFormula:
C15H23F3N2O3
MolecularWeight:
336.3499
MdlNumber:
MFCD22209660
Smiles:
O=C1NCC2([C@H](C1)C(F)(F)F)CCN(CC2)C(=O)OC(C)(C)C
Complexity:
477
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.1