tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate

C152H208N16O12S4Si4 — CID 157228189

IUPACtert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate
SMILESCc1nc2c(s1)CC[C@@H]2c1nc2cc(CC3CC[C@H]([C@H](O[Si](C)(C)C(C)(C)C)c4ccccc4)N3C(=O)OC(C)(C)C)ccc2n1C.Cc1nc2c(s1)CC[C@@H]2c1nc2ccc(CC3CC[C@H]([C@H](O[Si](C)(C)C(C)(C)C)c4ccccc4)N3C(=O)OC(C)(C)C)cc2n1C.Cc1nc2c(s1)CC[C@H]2c1nc2cc(CC3CC[C@H]([C@H](O[Si](C)(C)C(C)(C)C)c4ccccc4)N3C(=O)OC(C)(C)C)ccc2n1C.Cc1nc2c(s1)CC[C@H]2c1nc2ccc(CC3CC[C@H]([C@H](O[Si](C)(C)C(C)(C)C)c4ccccc4)N3C(=O)OC(C)(C)C)cc2n1C
InChIInChI=1S/4C38H52N4O3SSi/c2*1-24-39-33-28(18-21-32(33)46-24)35-40-29-23-25(16-19-30(29)41(35)8)22-27-17-20-31(42(27)36(43)44-37(2,3)4)34(26-14-12-11-13-15-26)45-47(9,10)38(5,6)7;2*1-24-39-33-28(18-21-32(33)46-24)35-40-29-19-16-25(23-31(29)41(35)8)22-27-17-20-30(42(27)36(43)44-37(2,3)4)34(26-14-12-11-13-15-26)45-47(9,10)38(5,6)7/h2*11-16,19,23,27-28,31,34H,17-18,20-22H2,1-10H3;2*11-16,19,23,27-28,30,34H,17-18,20-22H2,1-10H3/t27?,28-,31+,34+;27?,28-,31-,34-;27?,28-,30+,34+;27?,28-,30-,34-/m0101/s1
InChIKeyATUISSLPUVUHOJ-SAIIXQMRSA-N
MW2692.05 g/mol
LogP37.96
Rot. Bonds28

About tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate

tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate (PubChem CID 157228189) has the molecular formula C152H208N16O12S4Si4 and a molecular weight of 2692.05 g/mol. Its IUPAC name is tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate
PubChem CID157228189
Molecular FormulaC152H208N16O12S4Si4
Molecular Weight2692.05 g/mol
Exact Mass2689.41
IUPAC Nametert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate
SMILESCc1nc2c(s1)CC[C@@H]2c1nc2cc(CC3CC[C@H]([C@H](O[Si](C)(C)C(C)(C)C)c4ccccc4)N3C(=O)OC(C)(C)C)ccc2n1C.Cc1nc2c(s1)CC[C@@H]2c1nc2ccc(CC3CC[C@H]([C@H](O[Si](C)(C)C(C)(C)C)c4ccccc4)N3C(=O)OC(C)(C)C)cc2n1C.Cc1nc2c(s1)CC[C@H]2c1nc2cc(CC3CC[C@H]([C@H](O[Si](C)(C)C(C)(C)C)c4ccccc4)N3C(=O)OC(C)(C)C)ccc2n1C.Cc1nc2c(s1)CC[C@H]2c1nc2ccc(CC3CC[C@H]([C@H](O[Si](C)(C)C(C)(C)C)c4ccccc4)N3C(=O)OC(C)(C)C)cc2n1C
InChIInChI=1S/4C38H52N4O3SSi/c2*1-24-39-33-28(18-21-32(33)46-24)35-40-29-23-25(16-19-30(29)41(35)8)22-27-17-20-31(42(27)36(43)44-37(2,3)4)34(26-14-12-11-13-15-26)45-47(9,10)38(5,6)7;2*1-24-39-33-28(18-21-32(33)46-24)35-40-29-19-16-25(23-31(29)41(35)8)22-27-17-20-30(42(27)36(43)44-37(2,3)4)34(26-14-12-11-13-15-26)45-47(9,10)38(5,6)7/h2*11-16,19,23,27-28,31,34H,17-18,20-22H2,1-10H3;2*11-16,19,23,27-28,30,34H,17-18,20-22H2,1-10H3/t27?,28-,31+,34+;27?,28-,31-,34-;27?,28-,30+,34+;27?,28-,30-,34-/m0101/s1
InChIKeyATUISSLPUVUHOJ-SAIIXQMRSA-N
XLogP37.96
TPSA277.92 Ų
H-Bond Donors
H-Bond Acceptors28
Rotatable Bonds28
Heavy Atoms188
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002692.05
LogP ≤ 537.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1028

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate?
The IUPAC name of tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate (CID 157228189) is tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate.
What is the SMILES notation for tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate?
The canonical SMILES for tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate is Cc1nc2c(s1)CC[C@@H]2c1nc2cc(CC3CC[C@H]([C@H](O[Si](C)(C)C(C)(C)C)c4ccccc4)N3C(=O)OC(C)(C)C)ccc2n1C.Cc1nc2c(s1)CC[C@@H]2c1nc2ccc(CC3CC[C@H]([C@H](O[Si](C)(C)C(C)(C)C)c4ccccc4)N3C(=O)OC(C)(C)C)cc2n1C.Cc1nc2c(s1)CC[C@H]2c1nc2cc(CC3CC[C@H]([C@H](O[Si](C)(C)C(C)(C)C)c4ccccc4)N3C(=O)OC(C)(C)C)ccc2n1C.Cc1nc2c(s1)CC[C@H]2c1nc2ccc(CC3CC[C@H]([C@H](O[Si](C)(C)C(C)(C)C)c4ccccc4)N3C(=O)OC(C)(C)C)cc2n1C.
What is the InChIKey of tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate?
The InChIKey is ATUISSLPUVUHOJ-SAIIXQMRSA-N. The full InChI is InChI=1S/4C38H52N4O3SSi/c2*1-24-39-33-28(18-21-32(33)46-24)35-40-29-23-25(16-19-30(29)41(35)8)22-27-17-20-31(42(27)36(43)44-37(2,3)4)34(26-14-12-11-13-15-26)45-47(9,10)38(5,6)7;2*1-24-39-33-28(18-21-32(33)46-24)35-40-29-19-16-25(23-31(29)41(35)8)22-27-17-20-30(42(27)36(43)44-37(2,3)4)34(26-14-12-11-13-15-26)45-47(9,10)38(5,6)7/h2*11-16,19,23,27-28,31,34H,17-18,20-22H2,1-10H3;2*11-16,19,23,27-28,30,34H,17-18,20-22H2,1-10H3/t27?,28-,31+,34+;27?,28-,31-,34-;27?,28-,30+,34+;27?,28-,30-,34-/m0101/s1.
What are the key properties of tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate?
tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate has a molecular weight of 2692.05 g/mol, XLogP of 37.96, 28 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[1-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate;tert-butyl (2R)-2-[(R)-[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-5-[[3-methyl-2-[(4S)-2-methyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl]benzimidazol-5-yl]methyl]pyrrolidine-1-carboxylate is sourced from PubChem (CID 157228189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).