AV18642
1391728-17-8 | tert-butyl (3aR,4S,6aS)-3a-fluoro-4-(phenylmethoxycarbonylamino)-1,3,4,5,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxylate
Manufacturer: A2B Chem
CAS Number: 1391728-17-8
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Catalog Number
AV18642
Chemical Name
tert-butyl (3aR,4S,6aS)-3a-fluoro-4-(phenylmethoxycarbonylamino)-1,3,4,5,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxylate
Cas Number
1391728-17-8
Molecular Formula
C20H27FN2O4
Molecular Weight
378.4378
Mdl Number
MFCD22209659
Smiles
O=C(N[C@H]1CC[C@@H]2[C@@]1(F)CN(C2)C(=O)OC(C)(C)C)OCc1ccccc1
Complexity
559
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
3
Heavy Atom Count
27
Hydrogen Bond Acceptor Count
5
Hydrogen Bond Donor Count
1
Rotatable Bond Count
6
Xlogp3
3.1
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | tert-Butyl (3aR,4S,6aS)-3a-fluoro-4-(phenylmethoxycarbonylamino)-1,3,4,5,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxylate | ChemScene | ₹ 1,61,879.52 |
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Catalog Number: AV18642
Chemical Name: tert-butyl (3aR,4S,6aS)-3a-fluoro-4-(phenylmethoxycarbonylamino)-1,3,4,5,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxylate
Cas Number: 1391728-17-8
Molecular Formula: C20H27FN2O4
Molecular Weight: 378.4378
Mdl Number: MFCD22209659
Smiles: O=C(N[C@H]1CC[C@@H]2[C@@]1(F)CN(C2)C(=O)OC(C)(C)C)OCc1ccccc1
Complexity: 559
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 3
Heavy Atom Count: 27
Hydrogen Bond Acceptor Count: 5
Hydrogen Bond Donor Count: 1
Rotatable Bond Count: 6
Xlogp3: 3.1
Catalog Number:
AV18642
Chemical Name:
tert-butyl (3aR,4S,6aS)-3a-fluoro-4-(phenylmethoxycarbonylamino)-1,3,4,5,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxylate
Cas Number:
1391728-17-8
Molecular Formula:
C20H27FN2O4
Molecular Weight:
378.4378
Mdl Number:
MFCD22209659
Smiles:
O=C(N[C@H]1CC[C@@H]2[C@@]1(F)CN(C2)C(=O)OC(C)(C)C)OCc1ccccc1
Complexity:
559
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Rotatable Bond Count:
6
Xlogp3:
3.1
Catalog Number: __
Chemical Name: __
Cas Number: __
Molecular Formula: __
Molecular Weight: __
Mdl Number: __
Smiles: Cc1cc2nncn2nc1Cl
Complexity: 154
Covalently-Bonded Unit Count: __
Defined Atom Stereocenter Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Hydrogen Bond Donor Count: __
Rotatable Bond Count: __
Xlogp3: 1.1
Catalog Number:
__
Chemical Name:
__
Cas Number:
__
Molecular Formula:
__
Molecular Weight:
__
Mdl Number:
__
Smiles:
Cc1cc2nncn2nc1Cl
Complexity:
154
Covalently-Bonded Unit Count:
__
Defined Atom Stereocenter Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
__
Xlogp3:
1.1
Catalog Number: AV18644
Chemical Name: 1-O-tert-butyl 2-O-methyl (2S,4R)-4-fluoropyrrolidine-1,2-dicarboxylate
Cas Number: 1648910-85-3
Molecular Formula: C11H18FNO4
Molecular Weight: 247.2633
Mdl Number: MFCD07367993
Smiles: CC(C)(C)OC(=O)N1CC(CC1C(=O)OC)F
Complexity: __
Covalently-Bonded Unit Count: __
Defined Atom Stereocenter Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Hydrogen Bond Donor Count: __
Rotatable Bond Count: __
Xlogp3: __
Catalog Number:
AV18644
Chemical Name:
1-O-tert-butyl 2-O-methyl (2S,4R)-4-fluoropyrrolidine-1,2-dicarboxylate
Cas Number:
1648910-85-3
Molecular Formula:
C11H18FNO4
Molecular Weight:
247.2633
Mdl Number:
MFCD07367993
Smiles:
CC(C)(C)OC(=O)N1CC(CC1C(=O)OC)F
Complexity:
__
Covalently-Bonded Unit Count:
__
Defined Atom Stereocenter Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
__
Xlogp3:
__
Catalog Number: __
Chemical Name: __
Cas Number: __
Molecular Formula: __
Molecular Weight: __
Mdl Number: __
Smiles: CCOc1nc(ccc1C(=O)OCC)Oc1ccc(c(c1)C=O)Br
Complexity: 422
Covalently-Bonded Unit Count: __
Defined Atom Stereocenter Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Hydrogen Bond Donor Count: __
Rotatable Bond Count: __
Xlogp3: 3.8
Catalog Number:
__
Chemical Name:
__
Cas Number:
__
Molecular Formula:
__
Molecular Weight:
__
Mdl Number:
__
Smiles:
CCOc1nc(ccc1C(=O)OCC)Oc1ccc(c(c1)C=O)Br
Complexity:
422
Covalently-Bonded Unit Count:
__
Defined Atom Stereocenter Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
__
Xlogp3:
3.8