AI29113
1290627-64-3 | Tert-Butyl 5H-Spiro[Azetidine-3,6-Pyrido[3,2-E]Pyrrolo[1,2-A]Pyrazine]-1-Carboxylate
Manufacturer: A2B Chem
CAS Number: 1290627-64-3
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Catalog Number
AI29113
Chemical Name
Tert-Butyl 5H-Spiro[Azetidine-3,6-Pyrido[3,2-E]Pyrrolo[1,2-A]Pyrazine]-1-Carboxylate
Cas Number
1290627-64-3
Molecular Formula
C17H20N4O2
Molecular Weight
312.3663
Mdl Number
MFCD19442504
Smiles
O=C(N1CC2(C1)Nc1cccnc1-n1c2ccc1)OC(C)(C)C
Complexity
484
Covalently-Bonded Unit Count
1
Heavy Atom Count
23
Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
1
Rotatable Bond Count
2
Xlogp3
1.7
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Catalog Number: AI29113
Chemical Name: Tert-Butyl 5H-Spiro[Azetidine-3,6-Pyrido[3,2-E]Pyrrolo[1,2-A]Pyrazine]-1-Carboxylate
Cas Number: 1290627-64-3
Molecular Formula: C17H20N4O2
Molecular Weight: 312.3663
Mdl Number: MFCD19442504
Smiles: O=C(N1CC2(C1)Nc1cccnc1-n1c2ccc1)OC(C)(C)C
Complexity: 484
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 23
Hydrogen Bond Acceptor Count: 4
Hydrogen Bond Donor Count: 1
Rotatable Bond Count: 2
Xlogp3: 1.7
Catalog Number:
AI29113
Chemical Name:
Tert-Butyl 5H-Spiro[Azetidine-3,6-Pyrido[3,2-E]Pyrrolo[1,2-A]Pyrazine]-1-Carboxylate
Cas Number:
1290627-64-3
Molecular Formula:
C17H20N4O2
Molecular Weight:
312.3663
Mdl Number:
MFCD19442504
Smiles:
O=C(N1CC2(C1)Nc1cccnc1-n1c2ccc1)OC(C)(C)C
Complexity:
484
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Rotatable Bond Count:
2
Xlogp3:
1.7
Catalog Number: AI29114
Chemical Name: Rel-(4as,6r,7as)-4-tert-butyl 6-ethyl hexahydrocyclopenta[b][1,4]oxazine-4,6(4ah)-dicarboxylate
Cas Number: 1290627-68-7
Molecular Formula: C15H25NO5
Molecular Weight: 299.3627
Mdl Number: MFCD19442507
Smiles: CCOC(=O)[C@H]1C[C@H]2[C@H](C1)N(CCO2)C(=O)OC(C)(C)C
Complexity: 403
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 21
Hydrogen Bond Acceptor Count: 5
Hydrogen Bond Donor Count: __
Rotatable Bond Count: 5
Xlogp3: 1.6
Catalog Number:
AI29114
Chemical Name:
Rel-(4as,6r,7as)-4-tert-butyl 6-ethyl hexahydrocyclopenta[b][1,4]oxazine-4,6(4ah)-dicarboxylate
Cas Number:
1290627-68-7
Molecular Formula:
C15H25NO5
Molecular Weight:
299.3627
Mdl Number:
MFCD19442507
Smiles:
CCOC(=O)[C@H]1C[C@H]2[C@H](C1)N(CCO2)C(=O)OC(C)(C)C
Complexity:
403
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
5
Xlogp3:
1.6
Catalog Number: AI29115
Chemical Name: 1-Oxa-8-azaspiro[4.5]decan-2-ylmethanol
Cas Number: 1290627-73-4
Molecular Formula: C9H17NO2
Molecular Weight: 171.2368
Mdl Number: MFCD19442510
Smiles: OCC1CCC2(O1)CCNCC2
Complexity: __
Covalently-Bonded Unit Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Hydrogen Bond Donor Count: __
Rotatable Bond Count: __
Xlogp3: __
Catalog Number:
AI29115
Chemical Name:
1-Oxa-8-azaspiro[4.5]decan-2-ylmethanol
Cas Number:
1290627-73-4
Molecular Formula:
C9H17NO2
Molecular Weight:
171.2368
Mdl Number:
MFCD19442510
Smiles:
OCC1CCC2(O1)CCNCC2
Complexity:
__
Covalently-Bonded Unit Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
__
Xlogp3:
__
Catalog Number: AI29116
Chemical Name: (4S)-2-(2,4-Dichlorophenyl)-1,3-thiazolidine-4-carboxylic acid
Cas Number: 1290627-96-1
Molecular Formula: C10H9Cl2NO2S
Molecular Weight: 278.155
Mdl Number: MFCD18071263
Smiles: OC(=O)[C@H]1CSC(N1)c1ccc(cc1Cl)Cl
Complexity: __
Covalently-Bonded Unit Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Hydrogen Bond Donor Count: __
Rotatable Bond Count: __
Xlogp3: __
Catalog Number:
AI29116
Chemical Name:
(4S)-2-(2,4-Dichlorophenyl)-1,3-thiazolidine-4-carboxylic acid
Cas Number:
1290627-96-1
Molecular Formula:
C10H9Cl2NO2S
Molecular Weight:
278.155
Mdl Number:
MFCD18071263
Smiles:
OC(=O)[C@H]1CSC(N1)c1ccc(cc1Cl)Cl
Complexity:
__
Covalently-Bonded Unit Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
__
Xlogp3:
__